7-Amino-3-[(5-methyl-1,3,4-thiadiazol-2-ylthio)methyl]-3-cephem-4-carboxylic Acid, 99%

Name: 7-Amino-3-[(5-methyl-1,3,4-thiadiazol-2-ylthio)methyl]-3-cephem-4-carboxylic Acid, 99%
SKU: ACM30246334
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Catalog NumberACM30246334

CAS Number30246-33-4

CategoryOther Glass and Ceramic Materials

IUPAC Name

(7R)-7-amino-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Molecular Weight

344.4g/mol

Molecular Formula

C11H12N4O3S3

Canonical SMILES

CC1=NN=C(S1)SCC2=C(N3C(C(C3=O)N)SC2)C(=O)O

InChI

InChI=1S/C11H12N4O3S3/c1-4-13-14-11(21-4)20-3-5-2-19-9-6(12)8(16)15(9)7(5)10(17)18/h6,9H,2-3,12H2,1H3,(H,17,18)/t6-,9?/m1/s1

InChI Key

HJSGHKMSDOLGJJ-VJSCVCEBSA-N

Complexity

515

Covalently-Bonded Unit Count

EC Number

250-099-1

Exact Mass

344.007154g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

344.007154g/mol

Rotatable Bond Count

XLogP3

-3.2

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