2-[2-chloranyl-5-methyl-4-[(5-piperidin-1-ylsulfonylpyridin-2-yl)amino]phenyl]-2-(4-chlorophenyl)ethanenitrile

Systemtic Name: 2-[2-chloranyl-5-methyl-4-[(5-piperidin-1-ylsulfonylpyridin-2-yl)amino]phenyl]-2-(4-chlorophenyl)ethanenitrile Openeye Name: 2-[2-chloro-5-methyl-4-[[5-(1-piperidylsulfonyl)-2-pyridyl]amino]phenyl]-2-(4-chlorophenyl)acetonitrile CAS Name: 2-[2-chloro-5-methyl-4-[[5-(1-piperidinylsulfonyl)-2-pyridinyl]amino]phenyl]-2-(4-chlorophenyl)acetonitrile IUPAC Name: 2-[2-chloro-5-methyl-4-[(5-piperidin-1-ylsulfonylpyridin-2-yl)amino]phenyl]-2-(4-chlorophenyl)acetonitrile Traditional Name: 2-[2-chloro-5-methyl-4-[(5-piperidinosulfonyl-2-pyridyl)amino]phenyl]-2-(4-chlorophenyl)acetonitrile Formula: C25H24Cl2N4O2S MolecularWeight: 515.45466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3)Cl)C(C#N)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1NC2=NC=C(C=C2)S(=O)(=O)N3CCCCC3)Cl)C(C#N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H24Cl2N4O2S/c1-17-13-21(22(15-28)18-5-7-19(26)8-6-18)23(27)14-24(17)30-25-10-9-20(16-29-25)34(32,33)31-11-3-2-4-12-31/h5-10,13-14,16,22H,2-4,11-12H2,1H3,(H,29,30)