1-methyl-5-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-[1,4]diazepino[2,3-b]quinoxaline

Systemtic Name: 1-methyl-5-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-[1,4]diazepino[2,3-b]quinoxaline Openeye Name: 1-methyl-5-(p-tolylsulfonyl)-3,4-dihydro-2H-[1,4]diazepino[2,3-b]quinoxaline CAS Name: 1-methyl-5-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-[1,4]diazepino[2,3-b]quinoxaline IUPAC Name: 1-methyl-5-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-[1,4]diazepino[2,3-b]quinoxaline Traditional Name: 1-methyl-5-tosyl-3,4-dihydro-2H-[1,4]diazepino[2,3-b]quinoxaline Formula: C19H20N4O2S MolecularWeight: 368.4527

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(C3=NC4=CC=CC=C4N=C32)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(C3=NC4=CC=CC=C4N=C32)C

InChI

InChI=1S/C19H20N4O2S/c1-14-8-10-15(11-9-14)26(24,25)23-13-5-12-22(2)18-19(23)21-17-7-4-3-6-16(17)20-18/h3-4,6-11H,5,12-13H2,1-2H3