Vitas-M small molecule compound

N'-[(E)-(3-nitrophenyl)methylidene]-1,2-bis(propylsulfonyl)-7-(pyridin-4-yl)indolizine-3-carbohydrazide

Catalog ID
STK673234
SMILES CCCS(=O)(=O)c1c(C(=O)N/N=C/c2cccc(c2)[N+](=O)[O-])n2c(c1S(=O)(=O)CCC)cc(cc2)c1ccncc1

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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 C27H27N5O7S2 MW 597.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O7S2/c1-3-14-40(36,37)25-23-17-21(20-8-11-28-12-9-20)10-13-31(23)24(26(25)41(38,39)15-4-2)27(33)30-29-18-19-6-5-7-22(16-19)32(34)35/h5-13,16-18H,3-4,14-15H2,1-2H3,(H,30,33)/b29-18+
InChIKey
XAIDIEKVXPFLNK-RDRPBHBLSA-N
Synonyms

CCCS(=O)(=O)C1=C2C=C(C=CN2C(=C1S(=O)(=O)CCC)C(=O)NN=CC3=CC(=CC=C3)(N+)(=O)(O))C4=CC=NC=C4
CCCS(=O)(=O)c1c(C(=O)NN=Cc2cccc(c2)(N+)(=O)(O))n2c(c1S(=O)(=O)CCC)cc(cc2)c1ccncc1
InChI=1SC27H27N5O7S2c131440(3637)25231721(208112812920)101331(23)24(26(25)41(3839)1542)27(33)3029181965722(1619)32(34)35h5131618H341415H212H3(H3033)b2918+
MFCD01113535
N((E)(3nitrophenyl)methylidene)12bis(propylsulfonyl)7(pyridin4yl)indolizine3carbohydrazide
N((E)(3nitrophenyl)methylideneamino)12bis(propylsulfonyl)7pyridin4ylindolizine3carboxamide
N(3NITROBENZYLIDENE)12BIS(PROPYLSULFONYL)7(4PYRIDINYL)3INDOLIZINECARBOHYDRAZIDE
ZINC000005989254
ZINC102777995

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.