6-(4-chlorophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]-5-methylsulfonyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-chlorophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]-5-methylsulfonyl-pyridine-3-carbonitrile Openeye Name: 6-(4-chlorophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]-5-methylsulfonyl-pyridine-3-carbonitrile CAS Name: 6-(4-chlorophenyl)-2-[4-(3-chlorophenyl)-1-piperazinyl]-5-methylsulfonyl-3-pyridinecarbonitrile IUPAC Name: 6-(4-chlorophenyl)-2-[4-(3-chlorophenyl)piperazin-1-yl]-5-methylsulfonylpyridine-3-carbonitrile Traditional Name: 6-(4-chlorophenyl)-2-[4-(3-chlorophenyl)piperazino]-5-mesyl-nicotinonitrile Formula: C23H20Cl2N4O2S MolecularWeight: 487.4015

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(N=C(C(=C1)C#N)N2CCN(CC2)C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(N=C(C(=C1)C#N)N2CCN(CC2)C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H20Cl2N4O2S/c1-32(30,31)21-13-17(15-26)23(27-22(21)16-5-7-18(24)8-6-16)29-11-9-28(10-12-29)20-4-2-3-19(25)14-20/h2-8,13-14H,9-12H2,1H3