Vitas-M small molecule compound
N'-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]-5-propylthiophene-3-carbohydrazide
Catalog ID
STK431058
SMILES CCCc1scc(c1)C(=O)N/N=C/c1cc2OCOc2cc1[N+](=O)[O-]
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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 C16H15N3O5S MW 361.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O5S/c1-2-3-12-4-11(8-25-12)16(20)18-17-7-10-5-14-15(24-9-23-14)6-13(10)19(21)22/h4-8H,2-3,9H2,1H3,(H,18,20)/b17-7+InChIKey
AEJPPJVUWUZPPD-REZTVBANSA-NSynonyms
CCCC1=CC(=CS1)C(=O)NN=CC2=CC3=C(C=C2(N+)(=O)(O))OCO3
CCCc1scc(c1)C(=O)NN=Cc1cc2OCOc2cc1(N+)(=O)(O)
InChI=1SC16H15N3O5Sc12312411(82512)16(20)181771051415(2492314)613(10)19(21)22h48H239H21H3(H1820)b177+
MFCD03465734
N((1E)2(6NITRO(2HBENZO(D)13DIOXOLAN5YL))1AZAVINYL)(5PROPYL(3THIENYL))CARBOXAMIDE
N((E)(6nitro13benzodioxol5yl)methylidene)5propylthiophene3carbohydrazide
N((E)(6nitro13benzodioxol5yl)methylideneamino)5propylthiophene3carboxamide
ZINC000002738003
ZINC33553102
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