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

Systemtic Name: 2,5-dimethyl-4-[(2-propan-2-yloxyphenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-(2-isopropoxyanilino)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 2,5-dimethyl-4-(2-propan-2-yloxyanilino)-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 2,5-dimethyl-4-(2-propan-2-yloxyanilino)thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-(2-isopropoxyanilino)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C18H19N3O3S MolecularWeight: 357.42676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O3S/c1-9(2)24-13-8-6-5-7-12(13)21-16-14-10(3)15(18(22)23)25-17(14)20-11(4)19-16/h5-9H,1-4H3,(H,22,23)(H,19,20,21)