2-[4-methyl-2-(4-methylphenyl)sulfonyl-1,3-dihydropyrrolo[3,4-c]pyridin-6-yl]ethanenitrile

Systemtic Name: 2-[4-methyl-2-(4-methylphenyl)sulfonyl-1,3-dihydropyrrolo[3,4-c]pyridin-6-yl]ethanenitrile Openeye Name: 2-[4-methyl-2-(p-tolylsulfonyl)-1,3-dihydropyrrolo[3,4-c]pyridin-6-yl]acetonitrile CAS Name: 2-[4-methyl-2-(4-methylphenyl)sulfonyl-1,3-dihydropyrrolo[3,4-c]pyridin-6-yl]acetonitrile IUPAC Name: 2-[4-methyl-2-(4-methylphenyl)sulfonyl-1,3-dihydropyrrolo[3,4-c]pyridin-6-yl]acetonitrile Traditional Name: 2-(4-methyl-2-tosyl-1,3-dihydropyrrolo[3,4-c]pyridin-6-yl)acetonitrile Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC(=NC(=C3C2)C)CC#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=CC(=NC(=C3C2)C)CC#N

InChI

InChI=1S/C17H17N3O2S/c1-12-3-5-16(6-4-12)23(21,22)20-10-14-9-15(7-8-18)19-13(2)17(14)11-20/h3-6,9H,7,10-11H2,1-2H3