3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 3-[[4-[(4-cyanophenyl)methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 3-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 3-[4-(4-cyanobenzyl)piperazino]sulfonylbenzonitrile Formula: C19H18N4O2S MolecularWeight: 366.43682

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C19H18N4O2S/c20-13-16-4-6-17(7-5-16)15-22-8-10-23(11-9-22)26(24,25)19-3-1-2-18(12-19)14-21/h1-7,12H,8-11,15H2