3-(2-chlorophenyl)sulfanyl-N-(1H-pyrazol-4-yl)propanamide

Systemtic Name: 3-(2-chlorophenyl)sulfanyl-N-(1H-pyrazol-4-yl)propanamide Openeye Name: 3-(2-chlorophenyl)sulfanyl-N-(1H-pyrazol-4-yl)propanamide CAS Name: 3-[(2-chlorophenyl)thio]-N-(1H-pyrazol-4-yl)propanamide IUPAC Name: 3-(2-chlorophenyl)sulfanyl-N-(1H-pyrazol-4-yl)propanamide Traditional Name: 3-[(2-chlorophenyl)thio]-N-(1H-pyrazol-4-yl)propionamide Formula: C12H12ClN3OS MolecularWeight: 281.76118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)SCCC(=O)NC2=CNN=C2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)SCCC(=O)NC2=CNN=C2)Cl

InChI

InChI=1S/C12H12ClN3OS/c13-10-3-1-2-4-11(10)18-6-5-12(17)16-9-7-14-15-8-9/h1-4,7-8H,5-6H2,(H,14,15)(H,16,17)