6,7-dimethyl-2-phenyl-3-[4-(2,4,6-trimethylphenyl)sulfonyl-1,4-diazepan-1-yl]quinoxaline

Systemtic Name: 6,7-dimethyl-2-phenyl-3-[4-(2,4,6-trimethylphenyl)sulfonyl-1,4-diazepan-1-yl]quinoxaline Openeye Name: 6,7-dimethyl-2-phenyl-3-[4-(2,4,6-trimethylphenyl)sulfonyl-1,4-diazepan-1-yl]quinoxaline CAS Name: 6,7-dimethyl-2-phenyl-3-[4-(2,4,6-trimethylphenyl)sulfonyl-1,4-diazepan-1-yl]quinoxaline IUPAC Name: 6,7-dimethyl-2-phenyl-3-[4-(2,4,6-trimethylphenyl)sulfonyl-1,4-diazepan-1-yl]quinoxaline Traditional Name: 2-(4-mesitylsulfonyl-1,4-diazepan-1-yl)-6,7-dimethyl-3-phenyl-quinoxaline Formula: C30H34N4O2S MolecularWeight: 514.68156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCCN(CC2)C3=NC4=C(C=C(C(=C4)C)C)N=C3C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCCN(CC2)C3=NC4=C(C=C(C(=C4)C)C)N=C3C5=CC=CC=C5)C

InChI

InChI=1S/C30H34N4O2S/c1-20-16-23(4)29(24(5)17-20)37(35,36)34-13-9-12-33(14-15-34)30-28(25-10-7-6-8-11-25)31-26-18-21(2)22(3)19-27(26)32-30/h6-8,10-11,16-19H,9,12-15H2,1-5H3