3-chloranyl-N'-[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoyl]benzohydrazide

Systemtic Name: 3-chloranyl-N'-[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanoyl]benzohydrazide Openeye Name: 3-chloro-N'-[2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetyl]benzohydrazide CAS Name: 3-chloro-N'-[1-oxo-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethyl]benzohydrazide IUPAC Name: 3-chloro-N'-[2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetyl]benzohydrazide Traditional Name: 3-chloro-N'-[2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetyl]benzohydrazide Formula: C14H16ClN5O2S MolecularWeight: 353.82714

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NNC(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NNC(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C14H16ClN5O2S/c1-2-4-11-16-19-14(23)20(11)8-12(21)17-18-13(22)9-5-3-6-10(15)7-9/h3,5-7H,2,4,8H2,1H3,(H,17,21)(H,18,22)(H,19,23)