2-(phenylmethylsulfanyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 2-(phenylmethylsulfanyl)-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 2-benzylsulfanyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 2-(phenylmethylthio)-N-[[2-(1-pyrazolylmethyl)phenyl]methyl]propanamide IUPAC Name: 2-benzylsulfanyl-N-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 2-(benzylthio)-N-[2-(pyrazol-1-ylmethyl)benzyl]propionamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1CN2C=CC=N2)SCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1CN2C=CC=N2)SCC3=CC=CC=C3

InChI

InChI=1S/C21H23N3OS/c1-17(26-16-18-8-3-2-4-9-18)21(25)22-14-19-10-5-6-11-20(19)15-24-13-7-12-23-24/h2-13,17H,14-16H2,1H3,(H,22,25)