2-(4-chlorophenyl)sulfonyl-2-[3-[(3,4-dimethylphenyl)amino]quinoxalin-2-yl]ethanenitrile

Systemtic Name: 2-(4-chlorophenyl)sulfonyl-2-[3-[(3,4-dimethylphenyl)amino]quinoxalin-2-yl]ethanenitrile Openeye Name: 2-(4-chlorophenyl)sulfonyl-2-[3-(3,4-dimethylanilino)quinoxalin-2-yl]acetonitrile CAS Name: 2-(4-chlorophenyl)sulfonyl-2-[3-(3,4-dimethylanilino)-2-quinoxalinyl]acetonitrile IUPAC Name: 2-(4-chlorophenyl)sulfonyl-2-[3-(3,4-dimethylanilino)quinoxalin-2-yl]acetonitrile Traditional Name: 2-(4-chlorophenyl)sulfonyl-2-[3-(3,4-dimethylanilino)quinoxalin-2-yl]acetonitrile Formula: C24H19ClN4O2S MolecularWeight: 462.95126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C24H19ClN4O2S/c1-15-7-10-18(13-16(15)2)27-24-23(28-20-5-3-4-6-21(20)29-24)22(14-26)32(30,31)19-11-8-17(25)9-12-19/h3-13,22H,1-2H3,(H,27,29)