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5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid,7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(hydroxyimino)acetyl]amino]-3-[[(E,3'R)-1'-[[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxy]carbonyl]-2-oxo[1,3'-bipyrrolidin]-3-ylidene]methyl]-8-oxo-,(6R,7R)- (376653-43-9)

Identification
Name:5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid,7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(hydroxyimino)acetyl]amino]-3-[[(E,3'R)-1'-[[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxy]carbonyl]-2-oxo[1,3'-bipyrrolidin]-3-ylidene]methyl]-8-oxo-,(6R,7R)-
Synonyms:5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid,7-[[(2Z)-(5-amino-1,2,4-thiadiazol-3-yl)(hydroxyimino)acetyl]amino]-3-[(E)-[(3'R)-1'-[[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxy]carbonyl]-2-oxo[1,3'-bipyrrolidin]-3-ylidene]methyl]-8-oxo-,(6R,7R)- (9CI);Ceftobiprole medocaril;
CAS:376653-43-9
Molecular Formula: C26H26N8O11S2
Molecular Weight: 0
Molecular Structure: (C26H26N8O11S2) 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylicacid,7-[[(2Z)-(5-amino-1,2,4-thiadiazol-3-yl)(hydrox...
Properties
Density:1.95
Specification:

The Ceftobiprole medocaril with cas registry number of 376653-43-9, its system generated number is 0376653439. Its IUPAC name is (6R,7R)-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-ylidene)-2-nitrosoacetyl]amino]-3-[(E)-[1-[(3R)-1-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxycarbonyl]pyrrolidin-3-yl]-2-oxopyrrolidin-3-ylidene]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid.

Physical properties about this chemical are: (1)XLogP3-AA: -0.8; (2)H-Bond Donor: 4; (3)H-Bond Acceptor: 15; (4)Rotatable Bond Count: 8; (5)Tautomer Count: 138; (6)Exact Mass: 690.116245; (7)MonoIsotopic Mass: 690.116245; (8)Topological Polar Surface Area: 303; (9)Heavy Atom Count: 47; (10)Formal Charge: 0; (11)Complexity: 1670; (12)Isotope Atom Count: 0; (13)Defined Atom StereoCenter Count: 3; (14)Undefined Atom StereoCenter Count: 0; (15)Defined Bond StereoCenter Count: 2; (16)Undefined Bond StereoCenter Count: 0; (17)Covalently-Bonded Unit Count: 1.

You can still convert the following datas into molecular structure:  
(1)InChI: InChI=1S/C26H26N8O11S2/c1-10-14(45-26(41)44-10)8-43-25(40)32-4-3-13(7-32)33-5-2-11(20(33)36)6-12-9-46-22-16(21(37)34(22)17(12)23(38)39)28-19(35)15(30-42)18-29-24(27)47-31-18/h6,13,16,22,42H,2-5,7-9H2,1H3,(H,28,35)(H,38,39)(H2,27,29,31)/b11-6+,30-15-/t13-,16-,22-/m1/s1;
(2)SMILES: [C@H]1(C(=O)N2[C@@H]1SCC(=C2C(=O)O)/C=C1\CCN(C1=O)[C@H]1CN(CC1)C(=O)OCc1oc(=O)oc1C)NC(=O)C(=N\O)/c1nsc(n1)N.

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