2-(4-chlorophenyl)-3-methyl-4-(4-methylpiperazin-1-yl)-2-(6-methylpyridin-2-yl)butanenitrile

Systemtic Name: 2-(4-chlorophenyl)-3-methyl-4-(4-methylpiperazin-1-yl)-2-(6-methylpyridin-2-yl)butanenitrile Openeye Name: 2-(4-chlorophenyl)-3-methyl-4-(4-methylpiperazin-1-yl)-2-(6-methyl-2-pyridyl)butanenitrile CAS Name: 2-(4-chlorophenyl)-3-methyl-4-(4-methyl-1-piperazinyl)-2-(6-methyl-2-pyridinyl)butanenitrile IUPAC Name: 2-(4-chlorophenyl)-3-methyl-4-(4-methylpiperazin-1-yl)-2-(6-methylpyridin-2-yl)butanenitrile Traditional Name: 2-(4-chlorophenyl)-3-methyl-4-(4-methylpiperazino)-2-(6-methyl-2-pyridyl)butyronitrile Formula: C22H27ClN4 MolecularWeight: 382.92958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C(C#N)(C2=CC=C(C=C2)Cl)C(C)CN3CCN(CC3)C

Isomeric SMILES

CC1=NC(=CC=C1)C(C#N)(C2=CC=C(C=C2)Cl)C(C)CN3CCN(CC3)C

InChI

InChI=1S/C22H27ClN4/c1-17(15-27-13-11-26(3)12-14-27)22(16-24,19-7-9-20(23)10-8-19)21-6-4-5-18(2)25-21/h4-10,17H,11-15H2,1-3H3