N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenylsulfanyl-N-prop-2-enyl-ethanamide

Systemtic Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenylsulfanyl-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenylsulfanyl-acetamide CAS Name: N-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl]-2-(phenylthio)-N-prop-2-enylacetamide IUPAC Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-2-phenylsulfanyl-N-prop-2-enylacetamide Traditional Name: N-allyl-N-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl]-2-(phenylthio)acetamide Formula: C23H23ClN2OS MolecularWeight: 410.95952

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=CN1CC2=CC(=CC=C2)Cl)C(=O)CSC3=CC=CC=C3

Isomeric SMILES

C=CCN(CC1=CC=CN1CC2=CC(=CC=C2)Cl)C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C23H23ClN2OS/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/h2-12,14-15H,1,13,16-18H2