2-[[4-azanyl-5-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[4-azanyl-5-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-amino-5-[3-(p-tolyl)-1H-pyrazol-5-yl]-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[4-amino-5-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[4-amino-5-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[4-amino-5-[3-(p-tolyl)-1H-pyrazol-5-yl]-1,2,4-triazol-3-yl]thio]acetamide Formula: C14H15N7OS MolecularWeight: 329.3802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C2)C3=NN=C(N3N)SCC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C2)C3=NN=C(N3N)SCC(=O)N

InChI

InChI=1S/C14H15N7OS/c1-8-2-4-9(5-3-8)10-6-11(18-17-10)13-19-20-14(21(13)16)23-7-12(15)22/h2-6H,7,16H2,1H3,(H2,15,22)(H,17,18)