2-[4-(phenylmethyl)piperazin-1-yl]-2-thiophen-2-yl-ethanenitrile

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-yl]-2-thiophen-2-yl-ethanenitrile Openeye Name: 2-(4-benzylpiperazin-1-yl)-2-(2-thienyl)acetonitrile CAS Name: 2-[4-(phenylmethyl)-1-piperazinyl]-2-thiophen-2-ylacetonitrile IUPAC Name: 2-(4-benzylpiperazin-1-yl)-2-thiophen-2-ylacetonitrile Traditional Name: 2-(4-benzylpiperazino)-2-(2-thienyl)acetonitrile Formula: C17H19N3S MolecularWeight: 297.41786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(C#N)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(C#N)C3=CC=CS3

InChI

InChI=1S/C17H19N3S/c18-13-16(17-7-4-12-21-17)20-10-8-19(9-11-20)14-15-5-2-1-3-6-15/h1-7,12,16H,8-11,14H2