2-methyl-5-methylsulfanyl-4-(propylamino)thieno[3,4-d]pyrimidine-7-carboxylic acid

Systemtic Name: 2-methyl-5-methylsulfanyl-4-(propylamino)thieno[3,4-d]pyrimidine-7-carboxylic acid Openeye Name: 2-methyl-5-methylsulfanyl-4-(propylamino)thieno[3,4-d]pyrimidine-7-carboxylic acid CAS Name: 2-methyl-5-(methylthio)-4-(propylamino)-7-thieno[3,4-d]pyrimidinecarboxylic acid IUPAC Name: 2-methyl-5-methylsulfanyl-4-(propylamino)thieno[3,4-d]pyrimidine-7-carboxylic acid Traditional Name: 2-methyl-5-(methylthio)-4-(propylamino)thieno[3,4-d]pyrimidine-7-carboxylic acid Formula: C12H15N3O2S2 MolecularWeight: 297.3964

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC(=NC2=C(SC(=C21)SC)C(=O)O)C

Isomeric SMILES

CCCNC1=NC(=NC2=C(SC(=C21)SC)C(=O)O)C

InChI

InChI=1S/C12H15N3O2S2/c1-4-5-13-10-7-8(14-6(2)15-10)9(11(16)17)19-12(7)18-3/h4-5H2,1-3H3,(H,16,17)(H,13,14,15)