2-[[4-(4-methoxyphenyl)carbonylphenyl]methylsulfanyl]-3,5-dimethyl-quinazolin-4-one

Systemtic Name: 2-[[4-(4-methoxyphenyl)carbonylphenyl]methylsulfanyl]-3,5-dimethyl-quinazolin-4-one Openeye Name: 2-[[4-(4-methoxybenzoyl)phenyl]methylsulfanyl]-3,5-dimethyl-quinazolin-4-one CAS Name: 2-[[4-[(4-methoxyphenyl)-oxomethyl]phenyl]methylthio]-3,5-dimethyl-4-quinazolinone IUPAC Name: 2-[[4-(4-methoxybenzoyl)phenyl]methylsulfanyl]-3,5-dimethylquinazolin-4-one Traditional Name: 3,5-dimethyl-2-[(4-p-anisoylbenzyl)thio]quinazolin-4-one Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)N=C(N(C2=O)C)SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C2C(=CC=C1)N=C(N(C2=O)C)SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H22N2O3S/c1-16-5-4-6-21-22(16)24(29)27(2)25(26-21)31-15-17-7-9-18(10-8-17)23(28)19-11-13-20(30-3)14-12-19/h4-14H,15H2,1-3H3