(5E)-1-(3-bromophenyl)-5-[(3-iodanyl-4-methoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-1-(3-bromophenyl)-5-[(3-iodanyl-4-methoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-1-(3-bromophenyl)-5-[(3-iodo-4-methoxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-1-(3-bromophenyl)-5-[(3-iodo-4-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-1-(3-bromophenyl)-5-[(3-iodo-4-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-1-(3-bromophenyl)-5-(3-iodo-4-methoxy-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H12BrIN2O3S MolecularWeight: 543.17295

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)Br)I

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/2\C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)Br)I

InChI

InChI=1S/C18H12BrIN2O3S/c1-25-15-6-5-10(8-14(15)20)7-13-16(23)21-18(26)22(17(13)24)12-4-2-3-11(19)9-12/h2-9H,1H3,(H,21,23,26)/b13-7+