3-(4-phenylpiperazin-1-yl)sulfonylbenzenecarbonitrile

Systemtic Name: 3-(4-phenylpiperazin-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 3-(4-phenylpiperazin-1-yl)sulfonylbenzonitrile CAS Name: 3-[(4-phenyl-1-piperazinyl)sulfonyl]benzonitrile IUPAC Name: 3-(4-phenylpiperazin-1-yl)sulfonylbenzonitrile Traditional Name: 3-(4-phenylpiperazino)sulfonylbenzonitrile Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)S(=O)(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H17N3O2S/c18-14-15-5-4-8-17(13-15)23(21,22)20-11-9-19(10-12-20)16-6-2-1-3-7-16/h1-8,13H,9-12H2