N-(2,5-diphenylpyrazol-3-yl)-2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2,5-diphenylpyrazol-3-yl)-2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2,5-diphenylpyrazol-3-yl)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(2,5-diphenyl-3-pyrazolyl)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2,5-diphenylpyrazol-3-yl)-2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2,5-diphenylpyrazol-3-yl)-2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C22H22N6O2S MolecularWeight: 434.51408

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)NN=C1SCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N6O2S/c1-2-13-27-21(30)24-25-22(27)31-15-20(29)23-19-14-18(16-9-5-3-6-10-16)26-28(19)17-11-7-4-8-12-17/h3-12,14H,2,13,15H2,1H3,(H,23,29)(H,24,30)