5-[[1-(4-iodophenyl)pyrrol-2-yl]methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[[1-(4-iodophenyl)pyrrol-2-yl]methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[[1-(4-iodophenyl)pyrrol-2-yl]methylene]-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[[1-(4-iodophenyl)-2-pyrrolyl]methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[[1-(4-iodophenyl)pyrrol-2-yl]methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-[[1-(4-iodophenyl)pyrrol-2-yl]methylene]-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C17H14IN3O2S MolecularWeight: 451.28143

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC=CN2C3=CC=C(C=C3)I)C(=O)N(C1=S)C

Isomeric SMILES

CN1C(=O)C(=CC2=CC=CN2C3=CC=C(C=C3)I)C(=O)N(C1=S)C

InChI

InChI=1S/C17H14IN3O2S/c1-19-15(22)14(16(23)20(2)17(19)24)10-13-4-3-9-21(13)12-7-5-11(18)6-8-12/h3-10H,1-2H3