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

Systemtic Name: 4-[(3,4-dichlorophenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-(3,4-dichloroanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 4-(3,4-dichloroanilino)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 4-(3,4-dichloroanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-(3,4-dichloroanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C14H9Cl2N3O2S MolecularWeight: 354.21116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9Cl2N3O2S/c1-6-10-12(19-7-2-3-8(15)9(16)4-7)17-5-18-13(10)22-11(6)14(20)21/h2-5H,1H3,(H,20,21)(H,17,18,19)