2-(3-methylphenyl)sulfonyl-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]ethanenitrile

Systemtic Name: 2-(3-methylphenyl)sulfonyl-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]ethanenitrile Openeye Name: 2-[3-(4-methyl-1-piperidyl)quinoxalin-2-yl]-2-(m-tolylsulfonyl)acetonitrile CAS Name: 2-(3-methylphenyl)sulfonyl-2-[3-(4-methyl-1-piperidinyl)-2-quinoxalinyl]acetonitrile IUPAC Name: 2-(3-methylphenyl)sulfonyl-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetonitrile Traditional Name: 2-[3-(4-methylpiperidino)quinoxalin-2-yl]-2-(m-tolylsulfonyl)acetonitrile Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=CC(=C4)C

Isomeric SMILES

CC1CCN(CC1)C2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=CC(=C4)C

InChI

InChI=1S/C23H24N4O2S/c1-16-10-12-27(13-11-16)23-22(25-19-8-3-4-9-20(19)26-23)21(15-24)30(28,29)18-7-5-6-17(2)14-18/h3-9,14,16,21H,10-13H2,1-2H3