2-[6-iodanyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanamide

Systemtic Name: 2-[6-iodanyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanamide Openeye Name: 2-[6-iodo-3-(m-tolyl)-4-oxo-quinazolin-2-yl]sulfanylacetamide CAS Name: 2-[[6-iodo-3-(3-methylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: 2-[6-iodo-3-(3-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[6-iodo-4-keto-3-(m-tolyl)quinazolin-2-yl]thio]acetamide Formula: C17H14IN3O2S MolecularWeight: 451.28143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)N

InChI

InChI=1S/C17H14IN3O2S/c1-10-3-2-4-12(7-10)21-16(23)13-8-11(18)5-6-14(13)20-17(21)24-9-15(19)22/h2-8H,9H2,1H3,(H2,19,22)