2-[[5-[(Z)-N-benzamido-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[5-[(Z)-N-benzamido-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[5-[(Z)-N-benzamido-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methylsulfanyl]acetic acid CAS Name: 2-[[5-[(1Z)-1-(benzoylhydrazinylidene)ethyl]-2-methoxyphenyl]methylthio]acetic acid IUPAC Name: 2-[[5-[(Z)-N-benzamido-C-methylcarbonimidoyl]-2-methoxyphenyl]methylsulfanyl]acetic acid Traditional Name: 2-[[5-[(Z)-N-benzamido-C-methyl-carbonimidoyl]-2-methoxy-benzyl]thio]acetic acid Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=CC=C1)C2=CC(=C(C=C2)OC)CSCC(=O)O

Isomeric SMILES

C/C(=N/NC(=O)C1=CC=CC=C1)/C2=CC(=C(C=C2)OC)CSCC(=O)O

InChI

InChI=1S/C19H20N2O4S/c1-13(20-21-19(24)14-6-4-3-5-7-14)15-8-9-17(25-2)16(10-15)11-26-12-18(22)23/h3-10H,11-12H2,1-2H3,(H,21,24)(H,22,23)/b20-13-