5-methoxy-1-[4-(pyridin-4-ylmethylsulfanyl)phenyl]-6-(trifluoromethyl)-2,3-dihydroindole-2-carboxamide

Systemtic Name: 5-methoxy-1-[4-(pyridin-4-ylmethylsulfanyl)phenyl]-6-(trifluoromethyl)-2,3-dihydroindole-2-carboxamide Openeye Name: 5-methoxy-1-[4-(4-pyridylmethylsulfanyl)phenyl]-6-(trifluoromethyl)indoline-2-carboxamide CAS Name: 5-methoxy-1-[4-(pyridin-4-ylmethylthio)phenyl]-6-(trifluoromethyl)-2,3-dihydroindole-2-carboxamide IUPAC Name: 5-methoxy-1-[4-(pyridin-4-ylmethylsulfanyl)phenyl]-6-(trifluoromethyl)-2,3-dihydroindole-2-carboxamide Traditional Name: 5-methoxy-1-[4-(4-pyridylmethylthio)phenyl]-6-(trifluoromethyl)indoline-2-carboxamide Formula: C23H20F3N3O2S MolecularWeight: 459.48401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(N2C3=CC=C(C=C3)SCC4=CC=NC=C4)C(=O)N)C(F)(F)F

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(N2C3=CC=C(C=C3)SCC4=CC=NC=C4)C(=O)N)C(F)(F)F

InChI

InChI=1S/C23H20F3N3O2S/c1-31-21-11-15-10-20(22(27)30)29(19(15)12-18(21)23(24,25)26)16-2-4-17(5-3-16)32-13-14-6-8-28-9-7-14/h2-9,11-12,20H,10,13H2,1H3,(H2,27,30)