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

Systemtic Name: N-methyl-1-[2-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoyl]piperidine-4-carboxamide Openeye Name: N-methyl-1-[2-[2-(3-methylanilino)-2-oxo-ethyl]sulfanylacetyl]piperidine-4-carboxamide CAS Name: N-methyl-1-[2-[[2-(3-methylanilino)-2-oxoethyl]thio]-1-oxoethyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-1-[2-[2-(3-methylanilino)-2-oxoethyl]sulfanylacetyl]piperidine-4-carboxamide Traditional Name: 1-[2-[[2-keto-2-(m-toluidino)ethyl]thio]acetyl]-N-methyl-isonipecotamide Formula: C18H25N3O3S MolecularWeight: 363.4744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O3S/c1-13-4-3-5-15(10-13)20-16(22)11-25-12-17(23)21-8-6-14(7-9-21)18(24)19-2/h3-5,10,14H,6-9,11-12H2,1-2H3,(H,19,24)(H,20,22)