S-[2-[(3-azanyl-3-oxidanylidene-propyl)carbamoyl]-6-methoxy-phenyl] ethanethioate

Systemtic Name: S-[2-[(3-azanyl-3-oxidanylidene-propyl)carbamoyl]-6-methoxy-phenyl] ethanethioate Openeye Name: S-[2-[(3-amino-3-oxo-propyl)carbamoyl]-6-methoxy-phenyl] ethanethioate CAS Name: ethanethioic acid S-[2-[[(3-amino-3-oxopropyl)amino]-oxomethyl]-6-methoxyphenyl] ester IUPAC Name: S-[2-[(3-amino-3-oxopropyl)carbamoyl]-6-methoxyphenyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[(3-amino-3-keto-propyl)carbamoyl]-6-methoxy-phenyl] ester Formula: C13H16N2O4S MolecularWeight: 296.34214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1=C(C=CC=C1OC)C(=O)NCCC(=O)N

Isomeric SMILES

CC(=O)SC1=C(C=CC=C1OC)C(=O)NCCC(=O)N

InChI

InChI=1S/C13H16N2O4S/c1-8(16)20-12-9(4-3-5-10(12)19-2)13(18)15-7-6-11(14)17/h3-5H,6-7H2,1-2H3,(H2,14,17)(H,15,18)