5-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(4-benzyloxy-3-bromo-5-ethoxy-phenyl)methylene]-1-cyclohexyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-(4-benzoxy-3-bromo-5-ethoxy-benzylidene)-1-cyclohexyl-barbituric acid Formula: C26H27BrN2O5 MolecularWeight: 527.40698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3CCCCC3)Br)OCC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3CCCCC3)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C26H27BrN2O5/c1-2-33-22-15-18(14-21(27)23(22)34-16-17-9-5-3-6-10-17)13-20-24(30)28-26(32)29(25(20)31)19-11-7-4-8-12-19/h3,5-6,9-10,13-15,19H,2,4,7-8,11-12,16H2,1H3,(H,28,30,32)