5-[(3-bromanyl-4-butan-2-yloxy-phenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(3-bromanyl-4-butan-2-yloxy-phenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-bromo-4-sec-butoxy-phenyl)methylene]-1-(2-furylmethyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(3-bromo-4-butan-2-yloxyphenyl)methylidene]-1-(2-furanylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(3-bromo-4-butan-2-yloxyphenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-bromo-4-sec-butoxy-benzylidene)-1-(2-furfuryl)barbituric acid Formula: C20H19BrN2O5 MolecularWeight: 447.27926

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3)Br

Isomeric SMILES

CCC(C)OC1=C(C=C(C=C1)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3)Br

InChI

InChI=1S/C20H19BrN2O5/c1-3-12(2)28-17-7-6-13(10-16(17)21)9-15-18(24)22-20(26)23(19(15)25)11-14-5-4-8-27-14/h4-10,12H,3,11H2,1-2H3,(H,22,24,26)