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

Systemtic Name: 4-[(5-chloranyl-2-methoxy-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-(5-chloro-2-methoxy-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 4-(5-chloro-2-methoxyanilino)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 4-(5-chloro-2-methoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-(5-chloro-2-methoxy-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C15H12ClN3O3S MolecularWeight: 349.79208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12ClN3O3S/c1-7-11-13(17-6-18-14(11)23-12(7)15(20)21)19-9-5-8(16)3-4-10(9)22-2/h3-6H,1-2H3,(H,20,21)(H,17,18,19)