7-chloranyl-2-[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-methylphenyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[2-(2,5-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-3-(2-methylphenyl)quinazolin-4-one Openeye Name: 7-chloro-2-[2-(2,5-dimethylphenyl)-2-oxo-ethyl]sulfanyl-3-(o-tolyl)quinazolin-4-one CAS Name: 7-chloro-2-[[2-(2,5-dimethylphenyl)-2-oxoethyl]thio]-3-(2-methylphenyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[2-(2,5-dimethylphenyl)-2-oxoethyl]sulfanyl-3-(2-methylphenyl)quinazolin-4-one Traditional Name: 7-chloro-2-[[2-(2,5-dimethylphenyl)-2-keto-ethyl]thio]-3-(o-tolyl)quinazolin-4-one Formula: C25H21ClN2O2S MolecularWeight: 448.96444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=CC=C4C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C4=CC=CC=C4C

InChI

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