2-(4-fluorophenyl)sulfonyl-N-(2-pyridin-4-ylethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(4-fluorophenyl)sulfonyl-N-(2-pyridin-4-ylethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(4-fluorophenyl)sulfonyl-N-[2-(4-pyridyl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(4-fluorophenyl)sulfonyl-N-(2-pyridin-4-ylethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(4-fluorophenyl)sulfonyl-N-(2-pyridin-4-ylethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(4-fluorophenyl)sulfonyl-N-[2-(4-pyridyl)ethyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C23H22FN3O3S MolecularWeight: 439.502483

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)F)C(=O)NCCC4=CC=NC=C4

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)F)C(=O)NCCC4=CC=NC=C4

InChI

InChI=1S/C23H22FN3O3S/c24-20-5-7-21(8-6-20)31(29,30)27-16-19-4-2-1-3-18(19)15-22(27)23(28)26-14-11-17-9-12-25-13-10-17/h1-10,12-13,22H,11,14-16H2,(H,26,28)