N-[(4-methylphenyl)-thiophen-2-yl-methyl]-2-[4-(2-methylpropanoyl)piperazin-1-yl]ethanamide

Systemtic Name: N-[(4-methylphenyl)-thiophen-2-yl-methyl]-2-[4-(2-methylpropanoyl)piperazin-1-yl]ethanamide Openeye Name: 2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-[p-tolyl(2-thienyl)methyl]acetamide CAS Name: 2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-N-[(4-methylphenyl)-thiophen-2-ylmethyl]acetamide IUPAC Name: N-[(4-methylphenyl)-thiophen-2-ylmethyl]-2-[4-(2-methylpropanoyl)piperazin-1-yl]acetamide Traditional Name: 2-(4-isobutyrylpiperazino)-N-[p-tolyl(2-thienyl)methyl]acetamide Formula: C22H29N3O2S MolecularWeight: 399.54956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CN3CCN(CC3)C(=O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)CN3CCN(CC3)C(=O)C(C)C

InChI

InChI=1S/C22H29N3O2S/c1-16(2)22(27)25-12-10-24(11-13-25)15-20(26)23-21(19-5-4-14-28-19)18-8-6-17(3)7-9-18/h4-9,14,16,21H,10-13,15H2,1-3H3,(H,23,26)