2-butyl-3-[[4-[2-(2-cyclopropyl-2-oxidanylidene-ethyl)sulfonylphenyl]phenyl]methyl]-7-(dimethylamino)quinazolin-4-one

Systemtic Name: 2-butyl-3-[[4-[2-(2-cyclopropyl-2-oxidanylidene-ethyl)sulfonylphenyl]phenyl]methyl]-7-(dimethylamino)quinazolin-4-one Openeye Name: 2-butyl-3-[[4-[2-(2-cyclopropyl-2-oxo-ethyl)sulfonylphenyl]phenyl]methyl]-7-(dimethylamino)quinazolin-4-one CAS Name: 2-butyl-3-[[4-[2-(2-cyclopropyl-2-oxoethyl)sulfonylphenyl]phenyl]methyl]-7-(dimethylamino)-4-quinazolinone IUPAC Name: 2-butyl-3-[[4-[2-(2-cyclopropyl-2-oxoethyl)sulfonylphenyl]phenyl]methyl]-7-(dimethylamino)quinazolin-4-one Traditional Name: 2-butyl-3-[4-[2-(2-cyclopropyl-2-keto-ethyl)sulfonylphenyl]benzyl]-7-(dimethylamino)quinazolin-4-one Formula: C32H35N3O4S MolecularWeight: 557.703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=CC(=C2)N(C)C)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)CC(=O)C5CC5

Isomeric SMILES

CCCCC1=NC2=C(C=CC(=C2)N(C)C)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)CC(=O)C5CC5

InChI

InChI=1S/C32H35N3O4S/c1-4-5-10-31-33-28-19-25(34(2)3)17-18-27(28)32(37)35(31)20-22-11-13-23(14-12-22)26-8-6-7-9-30(26)40(38,39)21-29(36)24-15-16-24/h6-9,11-14,17-19,24H,4-5,10,15-16,20-21H2,1-3H3