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

Systemtic Name: 5-[(3-bromanyl-4-butan-2-yloxy-5-methoxy-phenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-bromo-5-methoxy-4-sec-butoxy-phenyl)methylene]-1-(2-furylmethyl)hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(3-bromo-4-butan-2-yloxy-5-methoxyphenyl)methylidene]-1-(2-furanylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(3-bromo-4-butan-2-yloxy-5-methoxyphenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-bromo-5-methoxy-4-sec-butoxy-benzylidene)-1-(2-furfuryl)barbituric acid Formula: C21H21BrN2O6 MolecularWeight: 477.30524

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C=C1Br)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3)OC

Isomeric SMILES

CCC(C)OC1=C(C=C(C=C1Br)C=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3)OC

InChI

InChI=1S/C21H21BrN2O6/c1-4-12(2)30-18-16(22)9-13(10-17(18)28-3)8-15-19(25)23-21(27)24(20(15)26)11-14-6-5-7-29-14/h5-10,12H,4,11H2,1-3H3,(H,23,25,27)