4-ethyl-7-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]-1H-quinoxaline-2,3-dione

Systemtic Name: 4-ethyl-7-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]-1H-quinoxaline-2,3-dione Openeye Name: 4-ethyl-7-[4-(p-tolylsulfonyl)-1,4-diazepane-1-carbonyl]-1H-quinoxaline-2,3-dione CAS Name: 4-ethyl-7-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]-oxomethyl]-1H-quinoxaline-2,3-dione IUPAC Name: 4-ethyl-7-[4-(4-methylphenyl)sulfonyl-1,4-diazepane-1-carbonyl]-1H-quinoxaline-2,3-dione Traditional Name: 4-ethyl-7-(4-tosyl-1,4-diazepane-1-carbonyl)-1H-quinoxaline-2,3-quinone Formula: C23H26N4O5S MolecularWeight: 470.54134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C)NC(=O)C1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C)NC(=O)C1=O

InChI

InChI=1S/C23H26N4O5S/c1-3-27-20-10-7-17(15-19(20)24-21(28)23(27)30)22(29)25-11-4-12-26(14-13-25)33(31,32)18-8-5-16(2)6-9-18/h5-10,15H,3-4,11-14H2,1-2H3,(H,24,28)