3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(2-fluorophenyl)ethyl]thiophene-2-carboxamide

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(2-fluorophenyl)ethyl]thiophene-2-carboxamide Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(2-fluorophenyl)ethyl]thiophene-2-carboxamide CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(2-fluorophenyl)ethyl]-2-thiophenecarboxamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(2-fluorophenyl)ethyl]thiophene-2-carboxamide Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)-N-[1-(2-fluorophenyl)ethyl]thiophene-2-carboxamide Formula: C22H21FN2O3S2 MolecularWeight: 444.542143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1F)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C1=CC=CC=C1F)NC(=O)C2=C(C=CS2)S(=O)(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H21FN2O3S2/c1-15(18-8-4-5-9-19(18)23)24-22(26)21-20(11-13-29-21)30(27,28)25-12-10-16-6-2-3-7-17(16)14-25/h2-9,11,13,15H,10,12,14H2,1H3,(H,24,26)