5-methyl-4-[(2-methyl-4-oxidanyl-phenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 5-methyl-4-[(2-methyl-4-oxidanyl-phenyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 4-(4-hydroxy-2-methyl-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(4-hydroxy-2-methylanilino)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 4-(4-hydroxy-2-methylanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(4-hydroxy-2-methyl-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C15H12N3O3S- MolecularWeight: 314.33908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)O)NC2=C3C(=C(SC3=NC=N2)C(=O)[O-])C

Isomeric SMILES

CC1=C(C=CC(=C1)O)NC2=C3C(=C(SC3=NC=N2)C(=O)[O-])C

InChI

InChI=1S/C15H13N3O3S/c1-7-5-9(19)3-4-10(7)18-13-11-8(2)12(15(20)21)22-14(11)17-6-16-13/h3-6,19H,1-2H3,(H,20,21)(H,16,17,18)/p-1