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

Systemtic Name: 4-[(4-hydroxyphenyl)-methyl-amino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-(4-hydroxy-N-methyl-anilino)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 4-(4-hydroxy-N-methylanilino)-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 4-(4-hydroxy-N-methylanilino)-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-(4-hydroxy-N-methyl-anilino)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C16H15N3O3S MolecularWeight: 329.3736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O3S/c1-8-12-14(19(3)10-4-6-11(20)7-5-10)17-9(2)18-15(12)23-13(8)16(21)22/h4-7,20H,1-3H3,(H,21,22)