2-(4-fluorophenyl)sulfonyl-N-[(2S)-2-phenylmethoxycyclopentyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(4-fluorophenyl)sulfonyl-N-[(2S)-2-phenylmethoxycyclopentyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-[(2S)-2-benzyloxycyclopentyl]-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(4-fluorophenyl)sulfonyl-N-[(2S)-2-phenylmethoxycyclopentyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(4-fluorophenyl)sulfonyl-N-[(2S)-2-phenylmethoxycyclopentyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-[(2S)-2-benzoxycyclopentyl]-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C28H29FN2O4S MolecularWeight: 508.604263

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)OCC2=CC=CC=C2)NC(=O)C3CC4=CC=CC=C4CN3S(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1C[C@@H](C(C1)NC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=C(C=C4)F)OCC5=CC=CC=C5

InChI

InChI=1S/C28H29FN2O4S/c29-23-13-15-24(16-14-23)36(33,34)31-18-22-10-5-4-9-21(22)17-26(31)28(32)30-25-11-6-12-27(25)35-19-20-7-2-1-3-8-20/h1-5,7-10,13-16,25-27H,6,11-12,17-19H2,(H,30,32)/t25?,26?,27-/m0/s1