N-[(2S)-1-(2,5-dihydropyrrol-1-yl)-4-methylsulfanyl-butan-2-yl]-2-(4-fluorophenyl)-N-methyl-ethanamide

Systemtic Name: N-[(2S)-1-(2,5-dihydropyrrol-1-yl)-4-methylsulfanyl-butan-2-yl]-2-(4-fluorophenyl)-N-methyl-ethanamide Openeye Name: N-[(1S)-1-(2,5-dihydropyrrol-1-ylmethyl)-3-methylsulfanyl-propyl]-2-(4-fluorophenyl)-N-methyl-acetamide CAS Name: N-[(2S)-1-(2,5-dihydropyrrol-1-yl)-4-(methylthio)butan-2-yl]-2-(4-fluorophenyl)-N-methylacetamide IUPAC Name: N-[(2S)-1-(2,5-dihydropyrrol-1-yl)-4-methylsulfanylbutan-2-yl]-2-(4-fluorophenyl)-N-methylacetamide Traditional Name: 2-(4-fluorophenyl)-N-methyl-N-[(1S)-3-(methylthio)-1-(3-pyrrolin-1-ylmethyl)propyl]acetamide Formula: C18H25FN2OS MolecularWeight: 336.467303

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CCSC)CN1CC=CC1)C(=O)CC2=CC=C(C=C2)F

Isomeric SMILES

CN([C@@H](CCSC)CN1CC=CC1)C(=O)CC2=CC=C(C=C2)F

InChI

InChI=1S/C18H25FN2OS/c1-20(18(22)13-15-5-7-16(19)8-6-15)17(9-12-23-2)14-21-10-3-4-11-21/h3-8,17H,9-14H2,1-2H3/t17-/m0/s1