N-(2-chloranyl-4-fluoranyl-phenyl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide CAS Name: N-(2-chloro-4-fluorophenyl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophene-2-carboxamide Formula: C20H16ClFN2O3S2 MolecularWeight: 450.934043

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(SC=C3)C(=O)NC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=C(SC=C3)C(=O)NC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C20H16ClFN2O3S2/c21-16-11-15(22)5-6-17(16)23-20(25)19-18(8-10-28-19)29(26,27)24-9-7-13-3-1-2-4-14(13)12-24/h1-6,8,10-11H,7,9,12H2,(H,23,25)