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

Systemtic Name: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-5-methylsulfonyl-6-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-5-methylsulfonyl-6-phenyl-pyridine-3-carbonitrile CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-5-methylsulfonyl-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-5-methylsulfonyl-6-phenylpyridine-3-carbonitrile Traditional Name: 2-[4-(4-chlorophenyl)sulfonylpiperazino]-5-mesyl-6-phenyl-nicotinonitrile Formula: C23H21ClN4O4S2 MolecularWeight: 517.02024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21ClN4O4S2/c1-33(29,30)21-15-18(16-25)23(26-22(21)17-5-3-2-4-6-17)27-11-13-28(14-12-27)34(31,32)20-9-7-19(24)8-10-20/h2-10,15H,11-14H2,1H3