3-azanyl-6-(3,4-dimethoxyphenyl)-N-pyrimidin-2-yl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-6-(3,4-dimethoxyphenyl)-N-pyrimidin-2-yl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-6-(3,4-dimethoxyphenyl)-N-pyrimidin-2-yl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-6-(3,4-dimethoxyphenyl)-N-(2-pyrimidinyl)-4-(trifluoromethyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-6-(3,4-dimethoxyphenyl)-N-pyrimidin-2-yl-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-6-(3,4-dimethoxyphenyl)-N-(2-pyrimidyl)-4-(trifluoromethyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C21H16F3N5O3S MolecularWeight: 475.44365

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(C(=C2)C(F)(F)F)C(=C(S3)C(=O)NC4=NC=CC=N4)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(C(=C2)C(F)(F)F)C(=C(S3)C(=O)NC4=NC=CC=N4)N)OC

InChI

InChI=1S/C21H16F3N5O3S/c1-31-13-5-4-10(8-14(13)32-2)12-9-11(21(22,23)24)15-16(25)17(33-19(15)28-12)18(30)29-20-26-6-3-7-27-20/h3-9H,25H2,1-2H3,(H,26,27,29,30)