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

Systemtic Name: 4-[(2-chloranyl-4,6-dimethyl-phenyl)amino]-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 4-(2-chloro-4,6-dimethyl-anilino)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(2-chloro-4,6-dimethylanilino)-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 4-(2-chloro-4,6-dimethylanilino)-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(2-chloro-4,6-dimethyl-anilino)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C17H15ClN3O2S- MolecularWeight: 360.8379

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN3O2S/c1-7-5-8(2)13(11(18)6-7)21-15-12-9(3)14(17(22)23)24-16(12)20-10(4)19-15/h5-6H,1-4H3,(H,22,23)(H,19,20,21)/p-1