1-butyl-2-(4-methoxyphenyl)-6-oxidanylidene-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide

Systemtic Name: 1-butyl-2-(4-methoxyphenyl)-6-oxidanylidene-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide Openeye Name: 1-butyl-2-(4-methoxyphenyl)-6-oxo-N-(2-thienylmethyl)piperidine-3-carboxamide CAS Name: 1-butyl-2-(4-methoxyphenyl)-6-oxo-N-(thiophen-2-ylmethyl)-3-piperidinecarboxamide IUPAC Name: 1-butyl-2-(4-methoxyphenyl)-6-oxo-N-(thiophen-2-ylmethyl)piperidine-3-carboxamide Traditional Name: 1-butyl-6-keto-2-(4-methoxyphenyl)-N-(2-thenyl)nipecotamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(CCC1=O)C(=O)NCC2=CC=CS2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCN1C(C(CCC1=O)C(=O)NCC2=CC=CS2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N2O3S/c1-3-4-13-24-20(25)12-11-19(22(26)23-15-18-6-5-14-28-18)21(24)16-7-9-17(27-2)10-8-16/h5-10,14,19,21H,3-4,11-13,15H2,1-2H3,(H,23,26)