N'-[3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanoyl]-2-oxidanyl-benzohydrazide

Systemtic Name: N'-[3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanoyl]-2-oxidanyl-benzohydrazide Openeye Name: N'-[3-[3-(4-ethoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanoyl]-2-hydroxy-benzohydrazide CAS Name: N'-[3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-oxopropyl]-2-hydroxybenzohydrazide IUPAC Name: N'-[3-[3-(4-ethoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]propanoyl]-2-hydroxybenzohydrazide Traditional Name: 2-hydroxy-N'-[3-(3-p-phenetyl-5-thioxo-1H-1,2,4-triazol-4-yl)propanoyl]benzohydrazide Formula: C20H21N5O4S MolecularWeight: 427.47684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NNC(=O)C3=CC=CC=C3O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=S)N2CCC(=O)NNC(=O)C3=CC=CC=C3O

InChI

InChI=1S/C20H21N5O4S/c1-2-29-14-9-7-13(8-10-14)18-22-24-20(30)25(18)12-11-17(27)21-23-19(28)15-5-3-4-6-16(15)26/h3-10,26H,2,11-12H2,1H3,(H,21,27)(H,23,28)(H,24,30)