Vitas-M small molecule compound
N'-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methylidene]-2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanehydrazide
Catalog ID
STK488180
SMILES COc1nn(cc1[N+](=O)[O-])C(C(=O)N/N=C/c1cc2OCOc2cc1Cl)C
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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 C15H14ClN5O6 MW 395.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14ClN5O6/c1-8(20-6-11(21(23)24)15(19-20)25-2)14(22)18-17-5-9-3-12-13(4-10(9)16)27-7-26-12/h3-6,8H,7H2,1-2H3,(H,18,22)/b17-5+InChIKey
XOQCHHIZTZZBPS-YAXRCOADSA-NSynonyms
CC(C(=O)NN=CC1=CC2=C(C=C1Cl)OCO2)N3C=C(C(=N3)OC)(N+)(=O)(O)
COc1nn(cc1(N+)(=O)(O))C(C(=O)NN=Cc1cc2OCOc2cc1Cl)C
InChI=1SC15H14ClN5O6c18(20611(21(23)24)15(1920)252)14(22)18175931213(410(9)16)2772612h368H7H212H3(H1822)b175+
MFCD09451285
N((1E)2(6CHLORO(2HBENZO(34D)13DIOXOLAN5YL))1AZAVINYL)2(3METHOXY4NITROPYRAZOLYL)PROPANAMIDE
N((E)(6chloro13benzodioxol5yl)methylidene)2(3methoxy4nitro1Hpyrazol1yl)propanehydrazide
N((E)(6chloro13benzodioxol5yl)methylideneamino)2(3methoxy4nitropyrazol1yl)propanamide
ZINC000013331860
ZINC000013331861
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