N-(3-iodanylphenyl)-2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-iodanylphenyl)-2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-iodophenyl)-2-(3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(3-iodophenyl)-2-[(3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(3-iodophenyl)-2-(3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(3-iodophenyl)-2-[(4-keto-3-methyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C15H12IN3O2S2 MolecularWeight: 457.30915

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12IN3O2S2/c1-19-14(21)11-5-6-22-13(11)18-15(19)23-8-12(20)17-10-4-2-3-9(16)7-10/h2-7H,8H2,1H3,(H,17,20)