4-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methylsulfanyl]-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 4-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methylsulfanyl]-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 4-[(4,6-diamino-1,3,5-triazin-2-yl)methylsulfanyl]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 4-[(4,6-diamino-1,3,5-triazin-2-yl)methylthio]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 4-[(4,6-diamino-1,3,5-triazin-2-yl)methylsulfanyl]-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 4-[(4,6-diamino-s-triazin-2-yl)methylthio]-2-keto-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C10H11N7O3S MolecularWeight: 309.30444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC2=NC(=NC(=N2)N)N)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC2=NC(=NC(=N2)N)N)C(=O)O

InChI

InChI=1S/C10H11N7O3S/c1-3-5(7(18)19)6(16-10(20)13-3)21-2-4-14-8(11)17-9(12)15-4/h2H2,1H3,(H,18,19)(H,13,16,20)(H4,11,12,14,15,17)