N-[(2-fluorophenyl)methyl]-2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-[(2-fluorophenyl)methyl]-2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(benzenesulfonyl)-N-[(2-fluorophenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(benzenesulfonyl)-N-[(2-fluorophenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(benzenesulfonyl)-N-[(2-fluorophenyl)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-besyl-N-(2-fluorobenzyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C23H21FN2O3S MolecularWeight: 424.487843

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)C(=O)NCC4=CC=CC=C4F

Isomeric SMILES

C1C(N(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)C(=O)NCC4=CC=CC=C4F

InChI

InChI=1S/C23H21FN2O3S/c24-21-13-7-6-9-18(21)15-25-23(27)22-14-17-8-4-5-10-19(17)16-26(22)30(28,29)20-11-2-1-3-12-20/h1-13,22H,14-16H2,(H,25,27)