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

Systemtic Name: 4-ethyl-7-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]-1H-quinoxaline-2,3-dione Openeye Name: 4-ethyl-7-[4-(4-fluorophenyl)sulfonyl-1,4-diazepane-1-carbonyl]-1H-quinoxaline-2,3-dione CAS Name: 4-ethyl-7-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-oxomethyl]-1H-quinoxaline-2,3-dione IUPAC Name: 4-ethyl-7-[4-(4-fluorophenyl)sulfonyl-1,4-diazepane-1-carbonyl]-1H-quinoxaline-2,3-dione Traditional Name: 4-ethyl-7-[4-(4-fluorophenyl)sulfonyl-1,4-diazepane-1-carbonyl]-1H-quinoxaline-2,3-quinone Formula: C22H23FN4O5S MolecularWeight: 474.505223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23FN4O5S/c1-2-27-19-9-4-15(14-18(19)24-20(28)22(27)30)21(29)25-10-3-11-26(13-12-25)33(31,32)17-7-5-16(23)6-8-17/h4-9,14H,2-3,10-13H2,1H3,(H,24,28)