5-chloranyl-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]carbonyl-1-benzofuran-2-carbohydrazide

Systemtic Name: 5-chloranyl-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]carbonyl-1-benzofuran-2-carbohydrazide Openeye Name: 5-chloro-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]benzofuran-2-carbohydrazide CAS Name: 5-chloro-N'-[[4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]-oxomethyl]-2-benzofurancarbohydrazide IUPAC Name: 5-chloro-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]-1-benzofuran-2-carbohydrazide Traditional Name: 5-chloro-N'-[4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzoyl]coumarilohydrazide Formula: C20H16ClN5O3S MolecularWeight: 441.89074

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CN1C=NN=C1SCC2=CC=C(C=C2)C(=O)NNC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C20H16ClN5O3S/c1-26-11-22-25-20(26)30-10-12-2-4-13(5-3-12)18(27)23-24-19(28)17-9-14-8-15(21)6-7-16(14)29-17/h2-9,11H,10H2,1H3,(H,23,27)(H,24,28)