2-[4-(1-benzothiophen-2-ylmethyl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-(1-benzothiophen-2-ylmethyl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-(benzothiophen-2-ylmethyl)piperazin-1-yl]benzonitrile CAS Name: 2-[4-(1-benzothiophen-2-ylmethyl)-1-piperazinyl]benzonitrile IUPAC Name: 2-[4-(1-benzothiophen-2-ylmethyl)piperazin-1-yl]benzonitrile Traditional Name: 2-[4-(benzothiophen-2-ylmethyl)piperazino]benzonitrile Formula: C20H19N3S MolecularWeight: 333.44996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=CC=CC=C3S2)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1CC2=CC3=CC=CC=C3S2)C4=CC=CC=C4C#N

InChI

InChI=1S/C20H19N3S/c21-14-17-6-1-3-7-19(17)23-11-9-22(10-12-23)15-18-13-16-5-2-4-8-20(16)24-18/h1-8,13H,9-12,15H2