N-[3-[3-(2-pyrazol-1-ylethylsulfanyl)-1,2,4-triazol-4-yl]phenyl]ethanamide

Systemtic Name: N-[3-[3-(2-pyrazol-1-ylethylsulfanyl)-1,2,4-triazol-4-yl]phenyl]ethanamide Openeye Name: N-[3-[3-(2-pyrazol-1-ylethylsulfanyl)-1,2,4-triazol-4-yl]phenyl]acetamide CAS Name: N-[3-[3-[2-(1-pyrazolyl)ethylthio]-1,2,4-triazol-4-yl]phenyl]acetamide IUPAC Name: N-[3-[3-(2-pyrazol-1-ylethylsulfanyl)-1,2,4-triazol-4-yl]phenyl]acetamide Traditional Name: N-[3-[3-(2-pyrazol-1-ylethylthio)-1,2,4-triazol-4-yl]phenyl]acetamide Formula: C15H16N6OS MolecularWeight: 328.39214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)N2C=NN=C2SCCN3C=CC=N3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)N2C=NN=C2SCCN3C=CC=N3

InChI

InChI=1S/C15H16N6OS/c1-12(22)18-13-4-2-5-14(10-13)21-11-16-19-15(21)23-9-8-20-7-3-6-17-20/h2-7,10-11H,8-9H2,1H3,(H,18,22)