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

Systemtic Name: 2-(3-chlorophenyl)sulfonyl-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]ethanenitrile Openeye Name: 2-(3-chlorophenyl)sulfonyl-2-[3-(4-methyl-1-piperidyl)quinoxalin-2-yl]acetonitrile CAS Name: 2-(3-chlorophenyl)sulfonyl-2-[3-(4-methyl-1-piperidinyl)-2-quinoxalinyl]acetonitrile IUPAC Name: 2-(3-chlorophenyl)sulfonyl-2-[3-(4-methylpiperidin-1-yl)quinoxalin-2-yl]acetonitrile Traditional Name: 2-(3-chlorophenyl)sulfonyl-2-[3-(4-methylpiperidino)quinoxalin-2-yl]acetonitrile Formula: C22H21ClN4O2S MolecularWeight: 440.94574

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C22H21ClN4O2S/c1-15-9-11-27(12-10-15)22-21(25-18-7-2-3-8-19(18)26-22)20(14-24)30(28,29)17-6-4-5-16(23)13-17/h2-8,13,15,20H,9-12H2,1H3