2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-N-(2-methyl-6-propan-2-yl-phenyl)ethanamide

Systemtic Name: 2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-N-(2-methyl-6-propan-2-yl-phenyl)ethanamide Openeye Name: 2-[4-(benzothiophen-3-ylmethyl)piperazin-1-yl]-N-(2-isopropyl-6-methyl-phenyl)acetamide CAS Name: 2-[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide IUPAC Name: 2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-N-(2-methyl-6-propan-2-ylphenyl)acetamide Traditional Name: 2-[4-(benzothiophen-3-ylmethyl)piperazino]-N-(2-isopropyl-6-methyl-phenyl)acetamide Formula: C25H31N3OS MolecularWeight: 421.59814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3OS/c1-18(2)21-9-6-7-19(3)25(21)26-24(29)16-28-13-11-27(12-14-28)15-20-17-30-23-10-5-4-8-22(20)23/h4-10,17-18H,11-16H2,1-3H3,(H,26,29)