2-[2-(4-fluoranyl-3-methyl-phenyl)-2-oxidanylidene-ethyl]sulfanyl-6-iodanyl-1H-quinazolin-4-one

Systemtic Name: 2-[2-(4-fluoranyl-3-methyl-phenyl)-2-oxidanylidene-ethyl]sulfanyl-6-iodanyl-1H-quinazolin-4-one Openeye Name: 2-[2-(4-fluoro-3-methyl-phenyl)-2-oxo-ethyl]sulfanyl-6-iodo-1H-quinazolin-4-one CAS Name: 2-[[2-(4-fluoro-3-methylphenyl)-2-oxoethyl]thio]-6-iodo-1H-quinazolin-4-one IUPAC Name: 2-[2-(4-fluoro-3-methylphenyl)-2-oxoethyl]sulfanyl-6-iodo-1H-quinazolin-4-one Traditional Name: 2-[[2-(4-fluoro-3-methyl-phenyl)-2-keto-ethyl]thio]-6-iodo-1H-quinazolin-4-one Formula: C17H12FIN2O2S MolecularWeight: 454.257253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)CSC2=NC(=O)C3=C(N2)C=CC(=C3)I)F

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)CSC2=NC(=O)C3=C(N2)C=CC(=C3)I)F

InChI

InChI=1S/C17H12FIN2O2S/c1-9-6-10(2-4-13(9)18)15(22)8-24-17-20-14-5-3-11(19)7-12(14)16(23)21-17/h2-7H,8H2,1H3,(H,20,21,23)