1-methyl-N'-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)phenyl]carbonyl-indole-3-carbohydrazide

Systemtic Name: 1-methyl-N'-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)phenyl]carbonyl-indole-3-carbohydrazide Openeye Name: 1-methyl-N'-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzoyl]indole-3-carbohydrazide CAS Name: 1-methyl-N'-[oxo-[4-[(1H-1,2,4-triazol-5-ylthio)methyl]phenyl]methyl]-3-indolecarbohydrazide IUPAC Name: 1-methyl-N'-[4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzoyl]indole-3-carbohydrazide Traditional Name: 1-methyl-N'-[4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzoyl]indole-3-carbohydrazide Formula: C20H18N6O2S MolecularWeight: 406.46092

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)NNC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)NNC(=O)C3=CC=C(C=C3)CSC4=NC=NN4

InChI

InChI=1S/C20H18N6O2S/c1-26-10-16(15-4-2-3-5-17(15)26)19(28)24-23-18(27)14-8-6-13(7-9-14)11-29-20-21-12-22-25-20/h2-10,12H,11H2,1H3,(H,23,27)(H,24,28)(H,21,22,25)