4-[(3,5-dimethylphenyl)amino]-2-[(4-fluorophenyl)amino]-7,8-dihydro-6H-quinazolin-5-one

Systemtic Name: 4-[(3,5-dimethylphenyl)amino]-2-[(4-fluorophenyl)amino]-7,8-dihydro-6H-quinazolin-5-one Openeye Name: 4-(3,5-dimethylanilino)-2-(4-fluoroanilino)-7,8-dihydro-6H-quinazolin-5-one CAS Name: 4-(3,5-dimethylanilino)-2-(4-fluoroanilino)-7,8-dihydro-6H-quinazolin-5-one IUPAC Name: 4-(3,5-dimethylanilino)-2-(4-fluoroanilino)-7,8-dihydro-6H-quinazolin-5-one Traditional Name: 4-(3,5-dimethylanilino)-2-(4-fluoroanilino)-7,8-dihydro-6H-quinazolin-5-one Formula: C22H21FN4O MolecularWeight: 376.426743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC(=NC3=C2C(=O)CCC3)NC4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC(=NC3=C2C(=O)CCC3)NC4=CC=C(C=C4)F)C

InChI

InChI=1S/C22H21FN4O/c1-13-10-14(2)12-17(11-13)24-21-20-18(4-3-5-19(20)28)26-22(27-21)25-16-8-6-15(23)7-9-16/h6-12H,3-5H2,1-2H3,(H2,24,25,26,27)