ethanedioic acid; 5-[(3-iodanyl-5-methoxy-4-propan-2-yloxy-phenyl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: ethanedioic acid; 5-[(3-iodanyl-5-methoxy-4-propan-2-yloxy-phenyl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(3-iodo-4-isopropoxy-5-methoxy-phenyl)methylene]-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-dione; oxalic acid CAS Name: 5-[(3-iodo-5-methoxy-4-propan-2-yloxyphenyl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione; oxalic acid IUPAC Name: 5-[(3-iodo-5-methoxy-4-propan-2-yloxyphenyl)methylidene]-1,3-dimethyl-2-sulfanylidene-1,3-diazinane-4,6-dione; oxalic acid Traditional Name: 5-(3-iodo-4-isopropoxy-5-methoxy-benzylidene)-1,3-dimethyl-2-thioxo-hexahydropyrimidine-4,6-quinone; oxalic acid Formula: C19H21IN2O8S MolecularWeight: 564.34811

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1I)C=C2C(=O)N(C(=S)N(C2=O)C)C)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1I)C=C2C(=O)N(C(=S)N(C2=O)C)C)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H19IN2O4S.C2H2O4/c1-9(2)24-14-12(18)7-10(8-13(14)23-5)6-11-15(21)19(3)17(25)20(4)16(11)22;3-1(4)2(5)6/h6-9H,1-5H3;(H,3,4)(H,5,6)