1-(3,4-dimethylphenyl)-5-[(5-iodanylfuran-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 1-(3,4-dimethylphenyl)-5-[(5-iodanylfuran-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 1-(3,4-dimethylphenyl)-5-[(5-iodo-2-furyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 1-(3,4-dimethylphenyl)-5-[(5-iodo-2-furanyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 1-(3,4-dimethylphenyl)-5-[(5-iodofuran-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 1-(3,4-dimethylphenyl)-5-[(5-iodo-2-furyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H13IN2O3S MolecularWeight: 452.26619

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)I)C(=O)NC2=S)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C(=CC3=CC=C(O3)I)C(=O)NC2=S)C

InChI

InChI=1S/C17H13IN2O3S/c1-9-3-4-11(7-10(9)2)20-16(22)13(15(21)19-17(20)24)8-12-5-6-14(18)23-12/h3-8H,1-2H3,(H,19,21,24)