6-azanyl-3-methyl-1-(2-methylpropyl)-5-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-3-methyl-1-(2-methylpropyl)-5-[2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-isobutyl-3-methyl-5-[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-3-methyl-1-(2-methylpropyl)-5-[1-oxo-2-(1H-1,2,4-triazol-5-ylthio)ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-3-methyl-1-(2-methylpropyl)-5-[2-(1H-1,2,4-triazol-5-ylsulfanyl)acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1-isobutyl-3-methyl-5-[2-(1H-1,2,4-triazol-5-ylthio)acetyl]pyrimidine-2,4-quinone Formula: C13H18N6O3S MolecularWeight: 338.38542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC=NN2)N

Isomeric SMILES

CC(C)CN1C(=C(C(=O)N(C1=O)C)C(=O)CSC2=NC=NN2)N

InChI

InChI=1S/C13H18N6O3S/c1-7(2)4-19-10(14)9(11(21)18(3)13(19)22)8(20)5-23-12-15-6-16-17-12/h6-7H,4-5,14H2,1-3H3,(H,15,16,17)