N-[3-(dimethylcarbamoyl)phenyl]-1-(4-methylphenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide

Systemtic Name: N-[3-(dimethylcarbamoyl)phenyl]-1-(4-methylphenyl)-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide Openeye Name: N-[3-(dimethylcarbamoyl)phenyl]-6-oxo-1-(p-tolyl)-2-(2-thienyl)piperidine-3-carboxamide CAS Name: N-[3-[dimethylamino(oxo)methyl]phenyl]-1-(4-methylphenyl)-6-oxo-2-thiophen-2-yl-3-piperidinecarboxamide IUPAC Name: N-[3-(dimethylcarbamoyl)phenyl]-1-(4-methylphenyl)-6-oxo-2-thiophen-2-ylpiperidine-3-carboxamide Traditional Name: N-[3-(dimethylcarbamoyl)phenyl]-6-keto-1-(p-tolyl)-2-(2-thienyl)nipecotamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NC3=CC=CC(=C3)C(=O)N(C)C)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NC3=CC=CC(=C3)C(=O)N(C)C)C4=CC=CS4

InChI

InChI=1S/C26H27N3O3S/c1-17-9-11-20(12-10-17)29-23(30)14-13-21(24(29)22-8-5-15-33-22)25(31)27-19-7-4-6-18(16-19)26(32)28(2)3/h4-12,15-16,21,24H,13-14H2,1-3H3,(H,27,31)