3-(2,3-dimethylphenyl)-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2,3-dimethylphenyl)-2-(4-oxidanylidene-4-phenyl-butyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(2,3-dimethylphenyl)-2-(4-oxo-4-phenyl-butyl)sulfanyl-quinazolin-4-one CAS Name: 3-(2,3-dimethylphenyl)-2-[(4-oxo-4-phenylbutyl)thio]-4-quinazolinone IUPAC Name: 3-(2,3-dimethylphenyl)-2-(4-oxo-4-phenylbutyl)sulfanylquinazolin-4-one Traditional Name: 3-(2,3-dimethylphenyl)-2-[(4-keto-4-phenyl-butyl)thio]quinazolin-4-one Formula: C26H24N2O2S MolecularWeight: 428.54596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCCCC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCCCC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C26H24N2O2S/c1-18-10-8-15-23(19(18)2)28-25(30)21-13-6-7-14-22(21)27-26(28)31-17-9-16-24(29)20-11-4-3-5-12-20/h3-8,10-15H,9,16-17H2,1-2H3