5-[(5-bromanyl-3-iodanyl-2-phenylmethoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(5-bromanyl-3-iodanyl-2-phenylmethoxy-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(2-benzyloxy-5-bromo-3-iodo-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(5-bromo-3-iodo-2-phenylmethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(5-bromo-3-iodo-2-phenylmethoxyphenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(2-benzoxy-5-bromo-3-iodo-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C18H12BrIN2O3S MolecularWeight: 543.17295

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2C=C3C(=O)NC(=S)NC3=O)Br)I

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2C=C3C(=O)NC(=S)NC3=O)Br)I

InChI

InChI=1S/C18H12BrIN2O3S/c19-12-6-11(7-13-16(23)21-18(26)22-17(13)24)15(14(20)8-12)25-9-10-4-2-1-3-5-10/h1-8H,9H2,(H2,21,22,23,24,26)