2-[1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]oxybenzenecarbonitrile

Systemtic Name: 2-[1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl]oxybenzenecarbonitrile Openeye Name: 2-[2-[4-(benzothiophen-3-ylmethyl)piperazin-1-yl]-1-methyl-2-oxo-ethoxy]benzonitrile CAS Name: 2-[1-[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-1-oxopropan-2-yl]oxybenzonitrile IUPAC Name: 2-[1-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-1-oxopropan-2-yl]oxybenzonitrile Traditional Name: 2-[2-[4-(benzothiophen-3-ylmethyl)piperazino]-2-keto-1-methyl-ethoxy]benzonitrile Formula: C23H23N3O2S MolecularWeight: 405.51262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)CC2=CSC3=CC=CC=C32)OC4=CC=CC=C4C#N

Isomeric SMILES

CC(C(=O)N1CCN(CC1)CC2=CSC3=CC=CC=C32)OC4=CC=CC=C4C#N

InChI

InChI=1S/C23H23N3O2S/c1-17(28-21-8-4-2-6-18(21)14-24)23(27)26-12-10-25(11-13-26)15-19-16-29-22-9-5-3-7-20(19)22/h2-9,16-17H,10-13,15H2,1H3