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

Systemtic Name: 5-methyl-4-[(2,4,6-trimethylphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 5-methyl-4-(2,4,6-trimethylanilino)thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 5-methyl-4-(2,4,6-trimethylanilino)-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 5-methyl-4-(2,4,6-trimethylanilino)thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-mesidino-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC2=C3C(=C(SC3=NC=N2)C(=O)O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC2=C3C(=C(SC3=NC=N2)C(=O)O)C)C

InChI

InChI=1S/C17H17N3O2S/c1-8-5-9(2)13(10(3)6-8)20-15-12-11(4)14(17(21)22)23-16(12)19-7-18-15/h5-7H,1-4H3,(H,21,22)(H,18,19,20)