6-azanyl-1,3-dimethyl-5-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1,3-dimethyl-5-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1,3-dimethyl-5-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1,3-dimethyl-5-[1-oxo-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1,3-dimethyl-5-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1,3-dimethyl-5-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]acetyl]pyrimidine-2,4-quinone Formula: C13H18N6O3S MolecularWeight: 338.38542

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC(=O)C2=C(N(C(=O)N(C2=O)C)C)N

Isomeric SMILES

CCCC1=NC(=NN1)SCC(=O)C2=C(N(C(=O)N(C2=O)C)C)N

InChI

InChI=1S/C13H18N6O3S/c1-4-5-8-15-12(17-16-8)23-6-7(20)9-10(14)18(2)13(22)19(3)11(9)21/h4-6,14H2,1-3H3,(H,15,16,17)