4-(4-pyrrolidin-1-ylsulfonylphenyl)-2-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine

Systemtic Name: 4-(4-pyrrolidin-1-ylsulfonylphenyl)-2-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine Openeye Name: 4-(4-pyrrolidin-1-ylsulfonylphenyl)-2-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine CAS Name: 4-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine IUPAC Name: 4-(4-pyrrolidin-1-ylsulfonylphenyl)-2-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine Traditional Name: 4-(4-pyrrolidinosulfonylphenyl)-2-(trifluoromethyl)-1H-pyrrolo[2,3-b]pyridine Formula: C18H16F3N3O2S MolecularWeight: 395.39875

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=C4C=C(NC4=NC=C3)C(F)(F)F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=C4C=C(NC4=NC=C3)C(F)(F)F

InChI

InChI=1S/C18H16F3N3O2S/c19-18(20,21)16-11-15-14(7-8-22-17(15)23-16)12-3-5-13(6-4-12)27(25,26)24-9-1-2-10-24/h3-8,11H,1-2,9-10H2,(H,22,23)