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

Systemtic Name: 4-(2-diethylaminoethylamino)-2-methyl-5-methylsulfanyl-thieno[3,4-d]pyrimidine-7-carboxylic acid Openeye Name: 4-(2-diethylaminoethylamino)-2-methyl-5-methylsulfanyl-thieno[3,4-d]pyrimidine-7-carboxylic acid CAS Name: 4-(2-diethylaminoethylamino)-2-methyl-5-(methylthio)-7-thieno[3,4-d]pyrimidinecarboxylic acid IUPAC Name: 4-(2-diethylaminoethylamino)-2-methyl-5-methylsulfanylthieno[3,4-d]pyrimidine-7-carboxylic acid Traditional Name: 4-(2-diethylaminoethylamino)-2-methyl-5-(methylthio)thieno[3,4-d]pyrimidine-7-carboxylic acid Formula: C15H22N4O2S2 MolecularWeight: 354.49078

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=NC(=NC2=C(SC(=C21)SC)C(=O)O)C

Isomeric SMILES

CCN(CC)CCNC1=NC(=NC2=C(SC(=C21)SC)C(=O)O)C

InChI

InChI=1S/C15H22N4O2S2/c1-5-19(6-2)8-7-16-13-10-11(17-9(3)18-13)12(14(20)21)23-15(10)22-4/h5-8H2,1-4H3,(H,20,21)(H,16,17,18)