Vitas-M small molecule compound
1-({2-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-5-nitrophenyl}sulfonyl)azepane
Catalog ID
STK755383
SMILES Clc1ccc(cc1)/C=N/Nc1ccc(cc1S(=O)(=O)N1CCCCCC1)[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 C19H21ClN4O4S MW 436.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClN4O4S/c20-16-7-5-15(6-8-16)14-21-22-18-10-9-17(24(25)26)13-19(18)29(27,28)23-11-3-1-2-4-12-23/h5-10,13-14,22H,1-4,11-12H2/b21-14+InChIKey
CZSZBTFUMGSTTO-KGENOOAVSA-NSynonyms
1((2((2E)2(4chlorobenzylidene)hydrazinyl)5nitrophenyl)sulfonyl)azepane
2(AZEPAN1YLSULFONYL)N((E)(4CHLOROPHENYL)METHYLIDENEAMINO)4NITROANILINE
C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)(N+)(=O)(O))NN=CC3=CC=C(C=C3)Cl
Clc1ccc(cc1)C=NNc1ccc(cc1S(=O)(=O)N1CCCCCC1)(N+)(=O)(O)
InChI=1SC19H21ClN4O4Sc20167515(6816)1421221810917(24(25)26)1319(18)29(2728)231131241223h510131422H141112H2b2114+
MFCD00758243
ZINC000012428954
ZINC33660263
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