(5R)-1-(4-bromanyl-3-methyl-phenyl)-5-(3-methoxypropyliminomethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: (5R)-1-(4-bromanyl-3-methyl-phenyl)-5-(3-methoxypropyliminomethyl)-1,3-diazinane-2,4,6-trione Openeye Name: (5R)-1-(4-bromo-3-methyl-phenyl)-5-(3-methoxypropyliminomethyl)hexahydropyrimidine-2,4,6-trione CAS Name: (5R)-1-(4-bromo-3-methylphenyl)-5-(3-methoxypropyliminomethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: (5R)-1-(4-bromo-3-methylphenyl)-5-(3-methoxypropyliminomethyl)-1,3-diazinane-2,4,6-trione Traditional Name: (5R)-1-(4-bromo-3-methyl-phenyl)-5-(3-methoxypropyliminomethyl)barbituric acid Formula: C16H18BrN3O4 MolecularWeight: 396.23582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C(=O)C(C(=O)NC2=O)C=NCCCOC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2C(=O)[C@@H](C(=O)NC2=O)C=NCCCOC)Br

InChI

InChI=1S/C16H18BrN3O4/c1-10-8-11(4-5-13(10)17)20-15(22)12(14(21)19-16(20)23)9-18-6-3-7-24-2/h4-5,8-9,12H,3,6-7H2,1-2H3,(H,19,21,23)/t12-/m1/s1