5-methyl-4-(3-methylbutylamino)thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 5-methyl-4-(3-methylbutylamino)thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-(isopentylamino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 5-methyl-4-(3-methylbutylamino)-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 5-methyl-4-(3-methylbutylamino)thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-(isoamylamino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C13H17N3O2S MolecularWeight: 279.35798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NCCC(C)C)C(=O)O

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NCCC(C)C)C(=O)O

InChI

InChI=1S/C13H17N3O2S/c1-7(2)4-5-14-11-9-8(3)10(13(17)18)19-12(9)16-6-15-11/h6-7H,4-5H2,1-3H3,(H,17,18)(H,14,15,16)