Vitas-M small molecule compound

N'-[(E)-1,3-benzodioxol-5-ylmethylidene]-5-propylthiophene-3-carbohydrazide

Catalog ID
STK430569
SMILES CCCc1scc(c1)C(=O)N/N=C/c1ccc2c(c1)OCO2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H16N2O3S MW 316.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O3S/c1-2-3-13-7-12(9-22-13)16(19)18-17-8-11-4-5-14-15(6-11)21-10-20-14/h4-9H,2-3,10H2,1H3,(H,18,19)/b17-8+
InChIKey
BPKAHVRIKPOJOT-CAOOACKPSA-N
Synonyms

CCCC1=CC(=CS1)C(=O)NN=CC2=CC3=C(C=C2)OCO3
CCCc1scc(c1)C(=O)NN=Cc1ccc2c(c1)OCO2
InChI=1SC16H16N2O3Sc12313712(92213)16(19)1817811451415(611)21102014h49H2310H21H3(H1819)b178+
MFCD03465401
N((1E)2(2HBENZO(34D)13DIOXOLAN5YL)1AZAVINYL)(5PROPYL(3THIENYL))CARBOXAMIDE
N((E)13benzodioxol5ylmethylidene)5propylthiophene3carbohydrazide
N((E)13benzodioxol5ylmethylideneamino)5propylthiophene3carboxamide
ZINC000002730584
ZINC33745789

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Available files

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