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

Systemtic Name: N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-1-(2-thenoyl)isonipecotamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C21H25N3O3S/c1-15-5-7-17(8-6-15)22-19(25)14-23(2)20(26)16-9-11-24(12-10-16)21(27)18-4-3-13-28-18/h3-8,13,16H,9-12,14H2,1-2H3,(H,22,25)