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

Systemtic Name: 2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[4-(benzothiophen-3-ylmethyl)piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[4-(benzothiophen-3-ylmethyl)piperazino]-N-(2,6-dimethylphenyl)acetamide Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3OS/c1-17-6-5-7-18(2)23(17)24-22(27)15-26-12-10-25(11-13-26)14-19-16-28-21-9-4-3-8-20(19)21/h3-9,16H,10-15H2,1-2H3,(H,24,27)