1-[4-[3-[4-(1-benzothiophen-4-yl)piperazin-1-yl]propoxy]-3-methoxy-5-methyl-phenyl]-4-ethanoyl-piperazin-2-one

Systemtic Name: 1-[4-[3-[4-(1-benzothiophen-4-yl)piperazin-1-yl]propoxy]-3-methoxy-5-methyl-phenyl]-4-ethanoyl-piperazin-2-one Openeye Name: 4-acetyl-1-[4-[3-[4-(benzothiophen-4-yl)piperazin-1-yl]propoxy]-3-methoxy-5-methyl-phenyl]piperazin-2-one CAS Name: 4-acetyl-1-[4-[3-[4-(1-benzothiophen-4-yl)-1-piperazinyl]propoxy]-3-methoxy-5-methylphenyl]-2-piperazinone IUPAC Name: 4-acetyl-1-[4-[3-[4-(1-benzothiophen-4-yl)piperazin-1-yl]propoxy]-3-methoxy-5-methylphenyl]piperazin-2-one Traditional Name: 4-acetyl-1-[4-[3-[4-(benzothiophen-4-yl)piperazino]propoxy]-3-methoxy-5-methyl-phenyl]piperazin-2-one Formula: C29H36N4O4S MolecularWeight: 536.68554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCN2CCN(CC2)C3=C4C=CSC4=CC=C3)OC)N5CCN(CC5=O)C(=O)C

Isomeric SMILES

CC1=CC(=CC(=C1OCCCN2CCN(CC2)C3=C4C=CSC4=CC=C3)OC)N5CCN(CC5=O)C(=O)C

InChI

InChI=1S/C29H36N4O4S/c1-21-18-23(33-15-14-32(22(2)34)20-28(33)35)19-26(36-3)29(21)37-16-5-9-30-10-12-31(13-11-30)25-6-4-7-27-24(25)8-17-38-27/h4,6-8,17-19H,5,9-16,20H2,1-3H3