1-[4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butyl]azepan-2-one

Systemtic Name: 1-[4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butyl]azepan-2-one Openeye Name: 1-[4-[4-(benzothiophen-4-yl)piperazin-1-yl]butyl]azepan-2-one CAS Name: 1-[4-[4-(1-benzothiophen-4-yl)-1-piperazinyl]butyl]-2-azepanone IUPAC Name: 1-[4-[4-(1-benzothiophen-4-yl)piperazin-1-yl]butyl]azepan-2-one Traditional Name: 1-[4-[4-(benzothiophen-4-yl)piperazino]butyl]azepan-2-one Formula: C22H31N3OS MolecularWeight: 385.56604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCCN2CCN(CC2)C3=C4C=CSC4=CC=C3

Isomeric SMILES

C1CCC(=O)N(CC1)CCCCN2CCN(CC2)C3=C4C=CSC4=CC=C3

InChI

InChI=1S/C22H31N3OS/c26-22-9-2-1-3-12-25(22)13-5-4-11-23-14-16-24(17-15-23)20-7-6-8-21-19(20)10-18-27-21/h6-8,10,18H,1-5,9,11-17H2