[4-[N-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]-C-methyl-carbonimidoyl]phenyl] ethanoate

Systemtic Name: [4-[N-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]-C-methyl-carbonimidoyl]phenyl] ethanoate Openeye Name: [4-[N-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-C-methyl-carbonimidoyl]phenyl] acetate CAS Name: acetic acid [4-[1-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]hydrazinylidene]ethyl]phenyl] ester IUPAC Name: [4-[N-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-C-methylcarbonimidoyl]phenyl] acetate Traditional Name: acetic acid [4-[N-[[2-(1,3-benzoxazol-2-ylthio)acetyl]amino]-C-methyl-carbonimidoyl]phenyl] ester Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CSC1=NC2=CC=CC=C2O1)C3=CC=C(C=C3)OC(=O)C

Isomeric SMILES

CC(=NNC(=O)CSC1=NC2=CC=CC=C2O1)C3=CC=C(C=C3)OC(=O)C

InChI

InChI=1S/C19H17N3O4S/c1-12(14-7-9-15(10-8-14)25-13(2)23)21-22-18(24)11-27-19-20-16-5-3-4-6-17(16)26-19/h3-10H,11H2,1-2H3,(H,22,24)