N'-[3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanoyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide

Systemtic Name: N'-[3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanoyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Openeye Name: N'-[3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanoyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide CAS Name: N'-[1-oxo-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide IUPAC Name: N'-[3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanoyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Traditional Name: N'-[3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanoyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide Formula: C18H17N5O4S2 MolecularWeight: 431.48868

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NNC(=O)CCN3C(=NNC3=S)C4=CC=CS4

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)C(=O)NNC(=O)CCN3C(=NNC3=S)C4=CC=CS4

InChI

InChI=1S/C18H17N5O4S2/c24-15(7-8-23-16(20-22-18(23)28)14-6-3-9-29-14)19-21-17(25)13-10-26-11-4-1-2-5-12(11)27-13/h1-6,9,13H,7-8,10H2,(H,19,24)(H,21,25)(H,22,28)