Vitas-M small molecule compound

3-chloro-6-nitro-N'-[(E)-(3-nitrophenyl)methylidene]-1-benzothiophene-2-carbohydrazide

Catalog ID
STK452847
SMILES [O-][N+](=O)c1cccc(c1)/C=N/NC(=O)c1sc2c(c1Cl)ccc(c2)[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 C16H9ClN4O5S MW 404.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H9ClN4O5S/c17-14-12-5-4-11(21(25)26)7-13(12)27-15(14)16(22)19-18-8-9-2-1-3-10(6-9)20(23)24/h1-8H,(H,19,22)/b18-8+
InChIKey
YTQSCOVNDLJJEZ-QGMBQPNBSA-N
Synonyms

(O)(N+)(=O)c1cccc(c1)C=NNC(=O)c1sc2c(c1Cl)ccc(c2)(N+)(=O)(O)
3chloro6nitroN((E)(3nitrophenyl)methylidene)1benzothiophene2carbohydrazide
3chloro6nitroN((E)(3nitrophenyl)methylideneamino)1benzothiophene2carboxamide
C1=CC(=CC(=C1)(N+)(=O)(O))C=NNC(=O)C2=C(C3=C(S2)C=C(C=C3)(N+)(=O)(O))Cl
InChI=1SC16H9ClN4O5Sc1714125411(21(25)26)713(12)2715(14)16(22)19188921310(69)20(23)24h18H(H1922)b188+
MFCD02606304
N((1E)2(3NITROPHENYL)1AZAVINYL)(3CHLORO6NITROBENZO(B)THIOPHEN2YL)CARBOXAMIDE
ZINC000002760924
ZINC35203411

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Available files

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