(5E)-5-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5E)-5-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5E)-1-allyl-5-[(4-benzyloxy-3-bromo-5-ethoxy-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5E)-5-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5E)-5-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylidene]-1-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5E)-1-allyl-5-(4-benzoxy-3-bromo-5-ethoxy-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C23H21BrN2O4S MolecularWeight: 501.39284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)CC=C)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=C/2\C(=O)NC(=S)N(C2=O)CC=C)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C23H21BrN2O4S/c1-3-10-26-22(28)17(21(27)25-23(26)31)11-16-12-18(24)20(19(13-16)29-4-2)30-14-15-8-6-5-7-9-15/h3,5-9,11-13H,1,4,10,14H2,2H3,(H,25,27,31)/b17-11+