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

Systemtic Name: 4-[(4-chloranyl-2-methoxy-5-methyl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-(4-chloro-2-methoxy-5-methyl-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 4-(4-chloro-2-methoxy-5-methylanilino)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 4-(4-chloro-2-methoxy-5-methylanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-(4-chloro-2-methoxy-5-methyl-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C16H14ClN3O3S MolecularWeight: 363.81866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC2=C3C(=C(SC3=NC=N2)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC2=C3C(=C(SC3=NC=N2)C(=O)O)C

InChI

InChI=1S/C16H14ClN3O3S/c1-7-4-10(11(23-3)5-9(7)17)20-14-12-8(2)13(16(21)22)24-15(12)19-6-18-14/h4-6H,1-3H3,(H,21,22)(H,18,19,20)