4-[(3-chloranyl-4-methyl-phenyl)amino]-2-[(4-ethylphenyl)amino]-7,7-dimethyl-6,8-dihydroquinazolin-5-one

Systemtic Name: 4-[(3-chloranyl-4-methyl-phenyl)amino]-2-[(4-ethylphenyl)amino]-7,7-dimethyl-6,8-dihydroquinazolin-5-one Openeye Name: 4-(3-chloro-4-methyl-anilino)-2-(4-ethylanilino)-7,7-dimethyl-6,8-dihydroquinazolin-5-one CAS Name: 4-(3-chloro-4-methylanilino)-2-(4-ethylanilino)-7,7-dimethyl-6,8-dihydroquinazolin-5-one IUPAC Name: 4-(3-chloro-4-methylanilino)-2-(4-ethylanilino)-7,7-dimethyl-6,8-dihydroquinazolin-5-one Traditional Name: 4-(3-chloro-4-methyl-anilino)-2-(4-ethylanilino)-7,7-dimethyl-6,8-dihydroquinazolin-5-one Formula: C25H27ClN4O MolecularWeight: 434.96108

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NC3=C(C(=O)CC(C3)(C)C)C(=N2)NC4=CC(=C(C=C4)C)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NC3=C(C(=O)CC(C3)(C)C)C(=N2)NC4=CC(=C(C=C4)C)Cl

InChI

InChI=1S/C25H27ClN4O/c1-5-16-7-10-17(11-8-16)28-24-29-20-13-25(3,4)14-21(31)22(20)23(30-24)27-18-9-6-15(2)19(26)12-18/h6-12H,5,13-14H2,1-4H3,(H2,27,28,29,30)