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

Systemtic Name: 2-ethylsulfonyl-N-[(3-fluorophenyl)methyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-ethylsulfonyl-N-[(3-fluorophenyl)methyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-ethylsulfonyl-N-[(3-fluorophenyl)methyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-ethylsulfonyl-N-[(3-fluorophenyl)methyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-esyl-N-(3-fluorobenzyl)-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C20H23FN2O3S MolecularWeight: 390.471623

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N(C)CC3=CC(=CC=C3)F

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N(C)CC3=CC(=CC=C3)F

InChI

InChI=1S/C20H23FN2O3S/c1-3-27(25,26)23-14-17-9-5-4-8-16(17)12-19(23)20(24)22(2)13-15-7-6-10-18(21)11-15/h4-11,19H,3,12-14H2,1-2H3