1,3-dimethyl-5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1,3-diazinane-2,4,6-trione

Systemtic Name: 1,3-dimethyl-5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1,3-diazinane-2,4,6-trione Openeye Name: 1,3-dimethyl-5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]hexahydropyrimidine-2,4,6-trione CAS Name: 1,3-dimethyl-5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1,3-diazinane-2,4,6-trione IUPAC Name: 1,3-dimethyl-5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1,3-diazinane-2,4,6-trione Traditional Name: 1,3-dimethyl-5-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]barbituric acid Formula: C15H15N5O3S MolecularWeight: 345.3763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SC3C(=O)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SC3C(=O)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C15H15N5O3S/c1-9-16-17-14(20(9)10-7-5-4-6-8-10)24-11-12(21)18(2)15(23)19(3)13(11)22/h4-8,11H,1-3H3