2-(4-chlorophenyl)sulfanyl-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]propanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]propanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]propanamide CAS Name: 2-[(4-chlorophenyl)thio]-N-[[2-(1-pyrazolyl)-4-pyridinyl]methyl]propanamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]propanamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]propionamide Formula: C18H17ClN4OS MolecularWeight: 372.87178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=NC=C1)N2C=CC=N2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C(=O)NCC1=CC(=NC=C1)N2C=CC=N2)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN4OS/c1-13(25-16-5-3-15(19)4-6-16)18(24)21-12-14-7-9-20-17(11-14)23-10-2-8-22-23/h2-11,13H,12H2,1H3,(H,21,24)