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

Systemtic Name: 4-[(4-dimethylaminophenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-[4-(dimethylamino)anilino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 4-[4-(dimethylamino)anilino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 4-[4-(dimethylamino)anilino]-5-methylthieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-[4-(dimethylamino)anilino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C16H16N4O2S MolecularWeight: 328.38884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)N(C)C)C(=O)O

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=C(C=C3)N(C)C)C(=O)O

InChI

InChI=1S/C16H16N4O2S/c1-9-12-14(17-8-18-15(12)23-13(9)16(21)22)19-10-4-6-11(7-5-10)20(2)3/h4-8H,1-3H3,(H,21,22)(H,17,18,19)