Vitas-M small molecule compound
2-methoxy-4-[(E)-{2-[(4-methyl-2-nitrophenoxy)acetyl]hydrazinylidene}methyl]phenyl thiophene-2-carboxylate
Catalog ID
STK256042
SMILES COc1cc(/C=N/NC(=O)COc2ccc(cc2[N+](=O)[O-])C)ccc1OC(=O)c1cccs1
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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 C22H19N3O7S MW 469.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O7S/c1-14-5-7-17(16(10-14)25(28)29)31-13-21(26)24-23-12-15-6-8-18(19(11-15)30-2)32-22(27)20-4-3-9-33-20/h3-12H,13H2,1-2H3,(H,24,26)/b23-12+InChIKey
VAETUGFAYFDRBV-FSJBWODESA-NSynonyms
(2methoxy4((E)((2(4methyl2nitrophenoxy)acetyl)hydrazinylidene)methyl)phenyl)thiophene2carboxylate
2methoxy4((E)(2((4methyl2nitrophenoxy)acetyl)hydrazinylidene)methyl)phenylthiophene2carboxylate
CC1=CC(=C(C=C1)OCC(=O)NN=CC2=CC(=C(C=C2)OC(=O)C3=CC=CS3)OC)(N+)(=O)(O)
COc1cc(C=NNC(=O)COc2ccc(cc2(N+)(=O)(O))C)ccc1OC(=O)c1cccs1
InChI=1SC22H19N3O7Sc1145717(16(1014)25(28)29)311321(26)242312156818(19(1115)302)3222(27)204393320h312H13H212H3(H2426)b2312+
MFCD08681639
ZINC000009355276
ZINC98031256
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