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

Systemtic Name: 1-(4-methylphenyl)-N-[2-(2-methylpropanoylamino)ethyl]-6-oxidanylidene-2-thiophen-2-yl-piperidine-3-carboxamide Openeye Name: N-[2-(2-methylpropanoylamino)ethyl]-6-oxo-1-(p-tolyl)-2-(2-thienyl)piperidine-3-carboxamide CAS Name: N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-1-(4-methylphenyl)-6-oxo-2-thiophen-2-yl-3-piperidinecarboxamide IUPAC Name: 1-(4-methylphenyl)-N-[2-(2-methylpropanoylamino)ethyl]-6-oxo-2-thiophen-2-ylpiperidine-3-carboxamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-6-keto-1-(p-tolyl)-2-(2-thienyl)nipecotamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NCCNC(=O)C(C)C)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(C(CCC2=O)C(=O)NCCNC(=O)C(C)C)C3=CC=CS3

InChI

InChI=1S/C23H29N3O3S/c1-15(2)22(28)24-12-13-25-23(29)18-10-11-20(27)26(17-8-6-16(3)7-9-17)21(18)19-5-4-14-30-19/h4-9,14-15,18,21H,10-13H2,1-3H3,(H,24,28)(H,25,29)