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

Systemtic Name: 6-azanyl-1,3-dimethyl-5-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1,3-dimethyl-5-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoyl]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]propyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1,3-dimethyl-5-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoyl]pyrimidine-2,4-dione Traditional Name: 6-amino-1,3-dimethyl-5-[2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]propanoyl]pyrimidine-2,4-quinone Formula: C14H20N6O3S MolecularWeight: 352.412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N6O3S/c1-5-6-8-16-13(18-17-8)24-7(2)10(21)9-11(15)19(3)14(23)20(4)12(9)22/h7H,5-6,15H2,1-4H3,(H,16,17,18)