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Cefozopran monohydrochloride

Catalog Number: EVT-253094

CAS Number: 113981-44-5

Molecular Formula: C19H18ClN9O5S2

Molecular Weight: 552 g/mol

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Product Introduction

Description

Cefozopran monohydrochloride is a third-generation cephalosporin antibiotic that is used to treat a wide range of bacterial infections. It was first introduced in Japan in 2009 and has since gained popularity due to its broad-spectrum activity against gram-positive and gram-negative bacteria.

Properties

CAS Number

113981-44-5

Product Name

Cefozopran monohydrochloride

IUPAC Name

(6R,7R)-7-[[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-methoxyiminoacetyl]amino]-3-(imidazo[1,2-b]pyridazin-1-ium-1-ylmethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate;hydrochloride

Molecular Formula

C19H18ClN9O5S2

Molecular Weight

552 g/mol

InChI

InChI=1S/C19H17N9O5S2.ClH/c1-33-24-11(14-23-19(20)35-25-14)15(29)22-12-16(30)28-13(18(31)32)9(8-34-17(12)28)7-26-5-6-27-10(26)3-2-4-21-27;/h2-6,12,17H,7-8H2,1H3,(H3-,20,22,23,25,29,31,32);1H/b24-11-;/t12-,17-;/m1./s1

InChI Key

NTJHUKMPVIFDNY-CZNPUCISSA-N

SMILES

CON=C(C1=NSC(=N1)N)C(=O)NC2C3N(C2=O)C(=C(CS3)C[N+]4=C5C=CC=NN5C=C4)C(=O)[O-].Cl

Canonical SMILES

CON=C(C1=NSC(=N1)N)C(=O)NC2C3N(C2=O)C(=C(CS3)C[N+]4=C5C=CC=NN5C=C4)C(=O)[O-].Cl

Isomeric SMILES

CO/N=C(\C1=NSC(=N1)N)/C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)C[N+]4=C5C=CC=NN5C=C4)C(=O)[O-].Cl

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