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

Systemtic Name: 4-[(2,6-dimethylphenyl)amino]-2-[(4-fluorophenyl)amino]-7,8-dihydro-6H-quinazolin-5-one Openeye Name: 4-(2,6-dimethylanilino)-2-(4-fluoroanilino)-7,8-dihydro-6H-quinazolin-5-one CAS Name: 4-(2,6-dimethylanilino)-2-(4-fluoroanilino)-7,8-dihydro-6H-quinazolin-5-one IUPAC Name: 4-(2,6-dimethylanilino)-2-(4-fluoroanilino)-7,8-dihydro-6H-quinazolin-5-one Traditional Name: 4-(2,6-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=C(C(=CC=C1)C)NC2=NC(=NC3=C2C(=O)CCC3)NC4=CC=C(C=C4)F

Isomeric SMILES

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

InChI

InChI=1S/C22H21FN4O/c1-13-5-3-6-14(2)20(13)26-21-19-17(7-4-8-18(19)28)25-22(27-21)24-16-11-9-15(23)10-12-16/h3,5-6,9-12H,4,7-8H2,1-2H3,(H2,24,25,26,27)