2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-iodanyl-2-methyl-phenyl)ethanamide

Systemtic Name: 2-[3-(3,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-iodanyl-2-methyl-phenyl)ethanamide Openeye Name: 2-[3-(3,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(4-iodo-2-methyl-phenyl)acetamide CAS Name: 2-[[3-(3,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(4-iodo-2-methylphenyl)acetamide IUPAC Name: 2-[3-(3,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-iodo-2-methylphenyl)acetamide Traditional Name: 2-[[3-(3,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-N-(4-iodo-2-methyl-phenyl)acetamide Formula: C25H22IN3O2S MolecularWeight: 555.43055

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=C(C=C4)I)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=C(C=C(C=C4)I)C)C

InChI

InChI=1S/C25H22IN3O2S/c1-15-10-16(2)12-19(11-15)29-24(31)20-6-4-5-7-22(20)28-25(29)32-14-23(30)27-21-9-8-18(26)13-17(21)3/h4-13H,14H2,1-3H3,(H,27,30)