7-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]-3-phenyl-1H-quinazoline-2,4-dione

Systemtic Name: 7-[(4-methylsulfonyl-1,4-diazepan-1-yl)carbonyl]-3-phenyl-1H-quinazoline-2,4-dione Openeye Name: 7-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)-3-phenyl-1H-quinazoline-2,4-dione CAS Name: 7-[(4-methylsulfonyl-1,4-diazepan-1-yl)-oxomethyl]-3-phenyl-1H-quinazoline-2,4-dione IUPAC Name: 7-(4-methylsulfonyl-1,4-diazepane-1-carbonyl)-3-phenyl-1H-quinazoline-2,4-dione Traditional Name: 7-(4-mesyl-1,4-diazepane-1-carbonyl)-3-phenyl-1H-quinazoline-2,4-quinone Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=O)N3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=O)N3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O5S/c1-31(29,30)24-11-5-10-23(12-13-24)19(26)15-8-9-17-18(14-15)22-21(28)25(20(17)27)16-6-3-2-4-7-16/h2-4,6-9,14H,5,10-13H2,1H3,(H,22,28)