2-[(4-fluorophenyl)amino]-7,7-dimethyl-4-phenylazanyl-6,8-dihydroquinazolin-5-one

Systemtic Name: 2-[(4-fluorophenyl)amino]-7,7-dimethyl-4-phenylazanyl-6,8-dihydroquinazolin-5-one Openeye Name: 4-anilino-2-(4-fluoroanilino)-7,7-dimethyl-6,8-dihydroquinazolin-5-one CAS Name: 4-anilino-2-(4-fluoroanilino)-7,7-dimethyl-6,8-dihydroquinazolin-5-one IUPAC Name: 4-anilino-2-(4-fluoroanilino)-7,7-dimethyl-6,8-dihydroquinazolin-5-one Traditional Name: 4-anilino-2-(4-fluoroanilino)-7,7-dimethyl-6,8-dihydroquinazolin-5-one Formula: C22H21FN4O MolecularWeight: 376.426743

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)C(=NC(=N2)NC3=CC=C(C=C3)F)NC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)C(=NC(=N2)NC3=CC=C(C=C3)F)NC4=CC=CC=C4)C

InChI

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