3-(4-chlorophenyl)-2-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-chlorophenyl)-2-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(4-chlorophenyl)-2-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(4-chlorophenyl)-2-[[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-(4-chlorophenyl)-2-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanylquinazolin-4-one Traditional Name: 3-(4-chlorophenyl)-2-[[2-keto-2-(2,4,5-trimethylphenyl)ethyl]thio]quinazolin-4-one Formula: C25H21ClN2O2S MolecularWeight: 448.96444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)Cl)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)Cl)C)C

InChI

InChI=1S/C25H21ClN2O2S/c1-15-12-17(3)21(13-16(15)2)23(29)14-31-25-27-22-7-5-4-6-20(22)24(30)28(25)19-10-8-18(26)9-11-19/h4-13H,14H2,1-3H3