N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]carbonylquinoline-8-carbohydrazide

Systemtic Name: N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]carbonylquinoline-8-carbohydrazide Openeye Name: N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]quinoline-8-carbohydrazide CAS Name: N'-[[4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]-oxomethyl]-8-quinolinecarbohydrazide IUPAC Name: N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]quinoline-8-carbohydrazide Traditional Name: N'-[4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzoyl]quinoline-8-carbohydrazide Formula: C21H18N6O2S MolecularWeight: 418.47162

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CN1C=NN=C1SCC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H18N6O2S/c1-27-13-23-26-21(27)30-12-14-7-9-16(10-8-14)19(28)24-25-20(29)17-6-2-4-15-5-3-11-22-18(15)17/h2-11,13H,12H2,1H3,(H,24,28)(H,25,29)