4-[4-[1-(1,5-dimethylpyrazol-3-yl)carbonylpiperidin-4-yl]sulfonylphenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[1-(1,5-dimethylpyrazol-3-yl)carbonylpiperidin-4-yl]sulfonylphenyl]benzenecarbonitrile Openeye Name: 4-[4-[[1-(1,5-dimethylpyrazole-3-carbonyl)-4-piperidyl]sulfonyl]phenyl]benzonitrile CAS Name: 4-[4-[[1-[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]-4-piperidinyl]sulfonyl]phenyl]benzonitrile IUPAC Name: 4-[4-[1-(1,5-dimethylpyrazole-3-carbonyl)piperidin-4-yl]sulfonylphenyl]benzonitrile Traditional Name: 4-[4-[[1-(1,5-dimethylpyrazole-3-carbonyl)-4-piperidyl]sulfonyl]phenyl]benzonitrile Formula: C24H24N4O3S MolecularWeight: 448.53736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N2CCC(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H24N4O3S/c1-17-15-23(26-27(17)2)24(29)28-13-11-22(12-14-28)32(30,31)21-9-7-20(8-10-21)19-5-3-18(16-25)4-6-19/h3-10,15,22H,11-14H2,1-2H3