1-[2-methyl-6-(4-thiophen-2-ylbutanoylamino)phenyl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[2-methyl-6-(4-thiophen-2-ylbutanoylamino)phenyl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[2-methyl-6-[4-(2-thienyl)butanoylamino]benzoyl]piperidine-4-carboxamide CAS Name: 1-[[2-methyl-6-[(1-oxo-4-thiophen-2-ylbutyl)amino]phenyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-methyl-6-(4-thiophen-2-ylbutanoylamino)benzoyl]piperidine-4-carboxamide Traditional Name: 1-[2-methyl-6-[4-(2-thienyl)butanoylamino]benzoyl]isonipecotamide Formula: C22H27N3O3S MolecularWeight: 413.53308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CCCC2=CC=CS2)C(=O)N3CCC(CC3)C(=O)N

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CCCC2=CC=CS2)C(=O)N3CCC(CC3)C(=O)N

InChI

InChI=1S/C22H27N3O3S/c1-15-5-2-8-18(24-19(26)9-3-6-17-7-4-14-29-17)20(15)22(28)25-12-10-16(11-13-25)21(23)27/h2,4-5,7-8,14,16H,3,6,9-13H2,1H3,(H2,23,27)(H,24,26)