2-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(1H-pyrazol-5-ylmethylamino)butan-2-yl]benzamide

Systemtic Name: 2-chloranyl-N-[4-methylsulfanyl-1-oxidanylidene-1-(1H-pyrazol-5-ylmethylamino)butan-2-yl]benzamide Openeye Name: 2-chloro-N-[3-methylsulfanyl-1-(1H-pyrazol-5-ylmethylcarbamoyl)propyl]benzamide CAS Name: 2-chloro-N-[4-(methylthio)-1-oxo-1-(1H-pyrazol-5-ylmethylamino)butan-2-yl]benzamide IUPAC Name: 2-chloro-N-[4-methylsulfanyl-1-oxo-1-(1H-pyrazol-5-ylmethylamino)butan-2-yl]benzamide Traditional Name: 2-chloro-N-[3-(methylthio)-1-(1H-pyrazol-5-ylmethylcarbamoyl)propyl]benzamide Formula: C16H19ClN4O2S MolecularWeight: 366.86566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CC=NN1)NC(=O)C2=CC=CC=C2Cl

Isomeric SMILES

CSCCC(C(=O)NCC1=CC=NN1)NC(=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C16H19ClN4O2S/c1-24-9-7-14(16(23)18-10-11-6-8-19-21-11)20-15(22)12-4-2-3-5-13(12)17/h2-6,8,14H,7,9-10H2,1H3,(H,18,23)(H,19,21)(H,20,22)