5-[3-(4-chlorophenyl)-4-oxidanyl-6-phenyl-5H-1,2,4-triazin-5-yl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[3-(4-chlorophenyl)-4-oxidanyl-6-phenyl-5H-1,2,4-triazin-5-yl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[3-(4-chlorophenyl)-4-hydroxy-6-phenyl-5H-1,2,4-triazin-5-yl]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[3-(4-chlorophenyl)-4-hydroxy-6-phenyl-5H-1,2,4-triazin-5-yl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[3-(4-chlorophenyl)-4-hydroxy-6-phenyl-5H-1,2,4-triazin-5-yl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[3-(4-chlorophenyl)-4-hydroxy-6-phenyl-5H-1,2,4-triazin-5-yl]-1,3-dimethyl-barbituric acid Formula: C21H18ClN5O4 MolecularWeight: 439.85172

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C(=O)N(C1=O)C)C2C(=NN=C(N2O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C(C(=O)N(C1=O)C)C2C(=NN=C(N2O)C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H18ClN5O4/c1-25-19(28)15(20(29)26(2)21(25)30)17-16(12-6-4-3-5-7-12)23-24-18(27(17)31)13-8-10-14(22)11-9-13/h3-11,15,17,31H,1-2H3