propyl 3-(2-acetamidoethylsulfanylmethyl)-4-oxidanylidene-4-pyridin-3-yl-butanoate

Systemtic Name: propyl 3-(2-acetamidoethylsulfanylmethyl)-4-oxidanylidene-4-pyridin-3-yl-butanoate Openeye Name: propyl 3-(2-acetamidoethylsulfanylmethyl)-4-oxo-4-(3-pyridyl)butanoate CAS Name: 3-[(2-acetamidoethylthio)methyl]-4-oxo-4-(3-pyridinyl)butanoic acid propyl ester IUPAC Name: propyl 3-(2-acetamidoethylsulfanylmethyl)-4-oxo-4-pyridin-3-ylbutanoate Traditional Name: 3-[(2-acetamidoethylthio)methyl]-4-keto-4-(3-pyridyl)butyric acid propyl ester Formula: C17H24N2O4S MolecularWeight: 352.44846

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CC(CSCCNC(=O)C)C(=O)C1=CN=CC=C1

Isomeric SMILES

CCCOC(=O)CC(CSCCNC(=O)C)C(=O)C1=CN=CC=C1

InChI

InChI=1S/C17H24N2O4S/c1-3-8-23-16(21)10-15(12-24-9-7-19-13(2)20)17(22)14-5-4-6-18-11-14/h4-6,11,15H,3,7-10,12H2,1-2H3,(H,19,20)