3-(2,6-dimethylphenyl)-2-[2-(4-methoxyphenyl)ethylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(2,6-dimethylphenyl)-2-[2-(4-methoxyphenyl)ethylsulfanyl]quinazolin-4-one Openeye Name: 3-(2,6-dimethylphenyl)-2-[2-(4-methoxyphenyl)ethylsulfanyl]quinazolin-4-one CAS Name: 3-(2,6-dimethylphenyl)-2-[2-(4-methoxyphenyl)ethylthio]-4-quinazolinone IUPAC Name: 3-(2,6-dimethylphenyl)-2-[2-(4-methoxyphenyl)ethylsulfanyl]quinazolin-4-one Traditional Name: 3-(2,6-dimethylphenyl)-2-[2-(4-methoxyphenyl)ethylthio]quinazolin-4-one Formula: C25H24N2O2S MolecularWeight: 416.53526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCCC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H24N2O2S/c1-17-7-6-8-18(2)23(17)27-24(28)21-9-4-5-10-22(21)26-25(27)30-16-15-19-11-13-20(29-3)14-12-19/h4-14H,15-16H2,1-3H3