6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-(p-tolylsulfonyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-(4-tosylpiperazino)nicotinonitrile Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=C(C=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C17H18N4O2S/c1-14-2-5-16(6-3-14)24(22,23)21-10-8-20(9-11-21)17-7-4-15(12-18)13-19-17/h2-7,13H,8-11H2,1H3