4-(methylsulfanylmethyl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide

Systemtic Name: 4-(methylsulfanylmethyl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Openeye Name: 4-(methylsulfanylmethyl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide CAS Name: 4-[(methylthio)methyl]-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]benzamide IUPAC Name: 4-(methylsulfanylmethyl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Traditional Name: 4-[(methylthio)methyl]-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide Formula: C20H21N3OS MolecularWeight: 351.46524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(C=C1)C(=O)NCCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CSCC1=CC=C(C=C1)C(=O)NCCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C20H21N3OS/c1-25-15-17-3-7-18(8-4-17)20(24)21-13-11-16-5-9-19(10-6-16)23-14-2-12-22-23/h2-10,12,14H,11,13,15H2,1H3,(H,21,24)