3-phenylsulfanyl-5-[[[3-(trifluoromethyl)phenyl]amino]methyl]-1H-indole-2-carboxamide

Systemtic Name: 3-phenylsulfanyl-5-[[[3-(trifluoromethyl)phenyl]amino]methyl]-1H-indole-2-carboxamide Openeye Name: 3-phenylsulfanyl-5-[[3-(trifluoromethyl)anilino]methyl]-1H-indole-2-carboxamide CAS Name: 3-(phenylthio)-5-[[3-(trifluoromethyl)anilino]methyl]-1H-indole-2-carboxamide IUPAC Name: 3-phenylsulfanyl-5-[[3-(trifluoromethyl)anilino]methyl]-1H-indole-2-carboxamide Traditional Name: 3-(phenylthio)-5-[[3-(trifluoromethyl)anilino]methyl]-1H-indole-2-carboxamide Formula: C23H18F3N3OS MolecularWeight: 441.46873

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(NC3=C2C=C(C=C3)CNC4=CC=CC(=C4)C(F)(F)F)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(NC3=C2C=C(C=C3)CNC4=CC=CC(=C4)C(F)(F)F)C(=O)N

InChI

InChI=1S/C23H18F3N3OS/c24-23(25,26)15-5-4-6-16(12-15)28-13-14-9-10-19-18(11-14)21(20(29-19)22(27)30)31-17-7-2-1-3-8-17/h1-12,28-29H,13H2,(H2,27,30)