N-ethyl-N-(2-pyridin-2-ylethyl)-2-[2,2,2-tris(fluoranyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide

Systemtic Name: N-ethyl-N-(2-pyridin-2-ylethyl)-2-[2,2,2-tris(fluoranyl)ethanoyl]-3,4-dihydro-1H-isoquinoline-7-sulfonamide Openeye Name: N-ethyl-N-[2-(2-pyridyl)ethyl]-2-(2,2,2-trifluoroacetyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide CAS Name: N-ethyl-N-[2-(2-pyridinyl)ethyl]-2-(2,2,2-trifluoro-1-oxoethyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide IUPAC Name: N-ethyl-N-(2-pyridin-2-ylethyl)-2-(2,2,2-trifluoroacetyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide Traditional Name: N-ethyl-N-[2-(2-pyridyl)ethyl]-2-(2,2,2-trifluoroacetyl)-3,4-dihydro-1H-isoquinoline-7-sulfonamide Formula: C20H22F3N3O3S MolecularWeight: 441.46719

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC1=CC=CC=N1)S(=O)(=O)C2=CC3=C(CCN(C3)C(=O)C(F)(F)F)C=C2

Isomeric SMILES

CCN(CCC1=CC=CC=N1)S(=O)(=O)C2=CC3=C(CCN(C3)C(=O)C(F)(F)F)C=C2

InChI

InChI=1S/C20H22F3N3O3S/c1-2-26(12-9-17-5-3-4-10-24-17)30(28,29)18-7-6-15-8-11-25(14-16(15)13-18)19(27)20(21,22)23/h3-7,10,13H,2,8-9,11-12,14H2,1H3