2-[2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]ethanoylamino]-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]ethanoylamino]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[[2-[4-(benzothiophen-3-ylmethyl)piperazin-1-yl]acetyl]amino]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[[2-[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-1-oxoethyl]amino]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[[2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]acetyl]amino]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[[2-[4-(benzothiophen-3-ylmethyl)piperazino]acetyl]amino]-N-(2,6-dimethylphenyl)acetamide Formula: C25H30N4O2S MolecularWeight: 450.5963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)CN2CCN(CC2)CC3=CSC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CNC(=O)CN2CCN(CC2)CC3=CSC4=CC=CC=C43

InChI

InChI=1S/C25H30N4O2S/c1-18-6-5-7-19(2)25(18)27-23(30)14-26-24(31)16-29-12-10-28(11-13-29)15-20-17-32-22-9-4-3-8-21(20)22/h3-9,17H,10-16H2,1-2H3,(H,26,31)(H,27,30)