2-[6-iodanyl-3-(2-methylprop-2-enyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-[6-iodanyl-3-(2-methylprop-2-enyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[6-iodo-3-(2-methylallyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[6-iodo-3-(2-methylprop-2-enyl)-4-oxo-2-quinazolinyl]thio]-N-phenylacetamide IUPAC Name: 2-[6-iodo-3-(2-methylprop-2-enyl)-4-oxoquinazolin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[6-iodo-4-keto-3-(2-methylallyl)quinazolin-2-yl]thio]-N-phenyl-acetamide Formula: C20H18IN3O2S MolecularWeight: 491.34529

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1C(=O)C2=C(C=CC(=C2)I)N=C1SCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC(=C)CN1C(=O)C2=C(C=CC(=C2)I)N=C1SCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H18IN3O2S/c1-13(2)11-24-19(26)16-10-14(21)8-9-17(16)23-20(24)27-12-18(25)22-15-6-4-3-5-7-15/h3-10H,1,11-12H2,2H3,(H,22,25)