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

Systemtic Name: 5-methyl-4-[(2-propan-2-yloxyphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-(2-isopropoxyanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 5-methyl-4-(2-propan-2-yloxyanilino)-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 5-methyl-4-(2-propan-2-yloxyanilino)thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-(2-isopropoxyanilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)NC3=CC=CC=C3OC(C)C)C(=O)O

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)NC3=CC=CC=C3OC(C)C)C(=O)O

InChI

InChI=1S/C17H17N3O3S/c1-9(2)23-12-7-5-4-6-11(12)20-15-13-10(3)14(17(21)22)24-16(13)19-8-18-15/h4-9H,1-3H3,(H,21,22)(H,18,19,20)