N-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenylsulfanyl-ethanamide Openeye Name: N-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenylsulfanyl-acetamide CAS Name: N-butyl-N-[[1-[(2-chlorophenyl)methyl]-2-pyrrolyl]methyl]-2-(phenylthio)acetamide IUPAC Name: N-butyl-N-[[1-[(2-chlorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenylsulfanylacetamide Traditional Name: N-butyl-N-[[1-(2-chlorobenzyl)pyrrol-2-yl]methyl]-2-(phenylthio)acetamide Formula: C24H27ClN2OS MolecularWeight: 427.00198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=CC=C2Cl)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=CC=C2Cl)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C24H27ClN2OS/c1-2-3-15-27(24(28)19-29-22-12-5-4-6-13-22)18-21-11-9-16-26(21)17-20-10-7-8-14-23(20)25/h4-14,16H,2-3,15,17-19H2,1H3