N'-(2-methoxy-5-methyl-phenyl)-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]ethanediamide

Systemtic Name: N'-(2-methoxy-5-methyl-phenyl)-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]ethanediamide Openeye Name: N'-(2-methoxy-5-methyl-phenyl)-N-[[1-(2-thienylmethyl)-4-piperidyl]methyl]oxamide CAS Name: N'-(2-methoxy-5-methylphenyl)-N-[[1-(thiophen-2-ylmethyl)-4-piperidinyl]methyl]oxamide IUPAC Name: N'-(2-methoxy-5-methylphenyl)-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]oxamide Traditional Name: N'-(2-methoxy-5-methyl-phenyl)-N-[[1-(2-thenyl)-4-piperidyl]methyl]oxamide Formula: C21H27N3O3S MolecularWeight: 401.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(=O)NCC2CCN(CC2)CC3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C(=O)NCC2CCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C21H27N3O3S/c1-15-5-6-19(27-2)18(12-15)23-21(26)20(25)22-13-16-7-9-24(10-8-16)14-17-4-3-11-28-17/h3-6,11-12,16H,7-10,13-14H2,1-2H3,(H,22,25)(H,23,26)