N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenylsulfanyl-N-propyl-ethanamide

Systemtic Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenylsulfanyl-N-propyl-ethanamide Openeye Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenylsulfanyl-N-propyl-acetamide CAS Name: N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-2-(phenylthio)-N-propylacetamide IUPAC Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenylsulfanyl-N-propylacetamide Traditional Name: N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-2-(phenylthio)-N-propyl-acetamide Formula: C23H25FN2OS MolecularWeight: 396.520803

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C23H25FN2OS/c1-2-13-26(23(27)18-28-22-11-4-3-5-12-22)17-21-10-7-14-25(21)16-19-8-6-9-20(24)15-19/h3-12,14-15H,2,13,16-18H2,1H3