3-chloranyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-(1-pyrrolidinyl)-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-pyrrolidino-5-(trifluoromethyl)phenyl]benzothiophene-2-carboxamide Formula: C20H16ClF3N2OS MolecularWeight: 424.86705

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C20H16ClF3N2OS/c21-17-13-5-1-2-6-16(13)28-18(17)19(27)25-14-11-12(20(22,23)24)7-8-15(14)26-9-3-4-10-26/h1-2,5-8,11H,3-4,9-10H2,(H,25,27)