2-[(4-chlorophenyl)amino]-7,7-dimethyl-4-[(3-methylphenyl)amino]-6,8-dihydroquinazolin-5-one

Systemtic Name: 2-[(4-chlorophenyl)amino]-7,7-dimethyl-4-[(3-methylphenyl)amino]-6,8-dihydroquinazolin-5-one Openeye Name: 2-(4-chloroanilino)-7,7-dimethyl-4-(3-methylanilino)-6,8-dihydroquinazolin-5-one CAS Name: 2-(4-chloroanilino)-7,7-dimethyl-4-(3-methylanilino)-6,8-dihydroquinazolin-5-one IUPAC Name: 2-(4-chloroanilino)-7,7-dimethyl-4-(3-methylanilino)-6,8-dihydroquinazolin-5-one Traditional Name: 2-(4-chloroanilino)-7,7-dimethyl-4-(m-toluidino)-6,8-dihydroquinazolin-5-one Formula: C23H23ClN4O MolecularWeight: 406.90792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC(=NC3=C2C(=O)CC(C3)(C)C)NC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC(=NC3=C2C(=O)CC(C3)(C)C)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H23ClN4O/c1-14-5-4-6-17(11-14)25-21-20-18(12-23(2,3)13-19(20)29)27-22(28-21)26-16-9-7-15(24)8-10-16/h4-11H,12-13H2,1-3H3,(H2,25,26,27,28)