3,6-bis(chloranyl)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[2-(1-pyrrolidinyl)-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[2-pyrrolidino-5-(trifluoromethyl)phenyl]benzothiophene-2-carboxamide Formula: C20H15Cl2F3N2OS MolecularWeight: 459.31211

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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=C(S3)C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H15Cl2F3N2OS/c21-12-4-5-13-16(10-12)29-18(17(13)22)19(28)26-14-9-11(20(23,24)25)3-6-15(14)27-7-1-2-8-27/h3-6,9-10H,1-2,7-8H2,(H,26,28)