3-(3,5-dimethylphenyl)-2-[(E)-2-(4-methylsulfanylphenyl)ethenyl]quinazolin-4-one

Systemtic Name: 3-(3,5-dimethylphenyl)-2-[(E)-2-(4-methylsulfanylphenyl)ethenyl]quinazolin-4-one Openeye Name: 3-(3,5-dimethylphenyl)-2-[(E)-2-(4-methylsulfanylphenyl)vinyl]quinazolin-4-one CAS Name: 3-(3,5-dimethylphenyl)-2-[(E)-2-[4-(methylthio)phenyl]ethenyl]-4-quinazolinone IUPAC Name: 3-(3,5-dimethylphenyl)-2-[(E)-2-(4-methylsulfanylphenyl)ethenyl]quinazolin-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-[(E)-2-[4-(methylthio)phenyl]vinyl]quinazolin-4-one Formula: C25H22N2OS MolecularWeight: 398.51998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=NC3=CC=CC=C3C2=O)C=CC4=CC=C(C=C4)SC)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=NC3=CC=CC=C3C2=O)/C=C/C4=CC=C(C=C4)SC)C

InChI

InChI=1S/C25H22N2OS/c1-17-14-18(2)16-20(15-17)27-24(13-10-19-8-11-21(29-3)12-9-19)26-23-7-5-4-6-22(23)25(27)28/h4-16H,1-3H3/b13-10+