3-chloranyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(trifluoromethyl)phenyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(trifluoromethyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-(trifluoromethyl)phenyl]benzothiophene-2-carboxamide Formula: C25H18ClF3N2OS MolecularWeight: 486.93643

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)C(F)(F)F)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)C(F)(F)F)NC(=O)C4=C(C5=CC=CC=C5S4)Cl

InChI

InChI=1S/C25H18ClF3N2OS/c26-22-18-7-3-4-8-21(18)33-23(22)24(32)30-19-13-17(25(27,28)29)9-10-20(19)31-12-11-15-5-1-2-6-16(15)14-31/h1-10,13H,11-12,14H2,(H,30,32)