1-(2-methylpropanoyl)-N-[3-(thiophen-2-ylcarbonylamino)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-(2-methylpropanoyl)-N-[3-(thiophen-2-ylcarbonylamino)phenyl]piperidine-3-carboxamide Openeye Name: 1-(2-methylpropanoyl)-N-[3-(thiophene-2-carbonylamino)phenyl]piperidine-3-carboxamide CAS Name: 1-(2-methyl-1-oxopropyl)-N-[3-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(2-methylpropanoyl)-N-[3-(thiophene-2-carbonylamino)phenyl]piperidine-3-carboxamide Traditional Name: 1-isobutyryl-N-[3-(2-thenoylamino)phenyl]nipecotamide Formula: C21H25N3O3S MolecularWeight: 399.5065

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCCC(C1)C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)C(=O)N1CCCC(C1)C(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CS3

InChI

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