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

Systemtic Name: 3-(4-methylphenyl)sulfanyl-N-(1H-pyrazol-4-yl)propanamide Openeye Name: 3-(p-tolylsulfanyl)-N-(1H-pyrazol-4-yl)propanamide CAS Name: 3-[(4-methylphenyl)thio]-N-(1H-pyrazol-4-yl)propanamide IUPAC Name: 3-(4-methylphenyl)sulfanyl-N-(1H-pyrazol-4-yl)propanamide Traditional Name: 3-(p-tolylthio)-N-(1H-pyrazol-4-yl)propionamide Formula: C13H15N3OS MolecularWeight: 261.3427

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NC2=CNN=C2

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NC2=CNN=C2

InChI

InChI=1S/C13H15N3OS/c1-10-2-4-12(5-3-10)18-7-6-13(17)16-11-8-14-15-9-11/h2-5,8-9H,6-7H2,1H3,(H,14,15)(H,16,17)