1-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoyl]piperidine-4-carboxamide

Systemtic Name: 1-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: 1-[2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanylacetyl]piperidine-4-carboxamide CAS Name: 1-[2-[[2-(3-methylanilino)-2-oxoethyl]thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[[2-keto-2-(m-toluidino)ethyl]thio]acetyl]isonipecotamide Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N2CCC(CC2)C(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N2CCC(CC2)C(=O)N

InChI

InChI=1S/C17H23N3O3S/c1-12-3-2-4-14(9-12)19-15(21)10-24-11-16(22)20-7-5-13(6-8-20)17(18)23/h2-4,9,13H,5-8,10-11H2,1H3,(H2,18,23)(H,19,21)