2-[7-chloranyl-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[7-chloranyl-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[7-chloro-3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[[7-chloro-3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[7-chloro-3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[[7-chloro-4-keto-3-(o-tolyl)quinazolin-2-yl]thio]-N-(2,6-dimethylphenyl)acetamide Formula: C25H22ClN3O2S MolecularWeight: 463.97908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22ClN3O2S/c1-15-7-4-5-10-21(15)29-24(31)19-12-11-18(26)13-20(19)27-25(29)32-14-22(30)28-23-16(2)8-6-9-17(23)3/h4-13H,14H2,1-3H3,(H,28,30)