N-[1-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoyl]piperidin-4-yl]benzamide

Systemtic Name: N-[1-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoyl]piperidin-4-yl]benzamide Openeye Name: N-[1-[2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanylacetyl]-4-piperidyl]benzamide CAS Name: N-[1-[2-[[2-(3-methylanilino)-2-oxoethyl]thio]-1-oxoethyl]-4-piperidinyl]benzamide IUPAC Name: N-[1-[2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[2-[[2-keto-2-(m-toluidino)ethyl]thio]acetyl]-4-piperidyl]benzamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N2CCC(CC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N2CCC(CC2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O3S/c1-17-6-5-9-20(14-17)24-21(27)15-30-16-22(28)26-12-10-19(11-13-26)25-23(29)18-7-3-2-4-8-18/h2-9,14,19H,10-13,15-16H2,1H3,(H,24,27)(H,25,29)