Vitas-M small molecule compound
2-methoxy-6-[(E)-{2-[(3-nitrophenyl)carbonyl]hydrazinylidene}methyl]phenyl 4-methylbenzenesulfonate
Catalog ID
STL164145
SMILES COc1cccc(c1OS(=O)(=O)c1ccc(cc1)C)/C=N/NC(=O)c1cccc(c1)[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 C22H19N3O7S MW 469.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O7S/c1-15-9-11-19(12-10-15)33(29,30)32-21-17(6-4-8-20(21)31-2)14-23-24-22(26)16-5-3-7-18(13-16)25(27)28/h3-14H,1-2H3,(H,24,26)/b23-14+InChIKey
PSMJDXRGOWZDJE-OEAKJJBVSA-NSynonyms
494757-17-4(2METHOXY6((E)((3NITROBENZOYL)HYDRAZINYLIDENE)METHYL)PHENYL)4METHYLBENZENESULFONATE
2(2(3NITROBENZOYL)CARBOHYDRAZONOYL)6METHOXYPHENYL4METHYLBENZENESULFONATE
2methoxy6((E)(2((3nitrophenyl)carbonyl)hydrazinylidene)methyl)phenyl4methylbenzenesulfonate
494757174
CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2OC)C=NNC(=O)C3=CC(=CC=C3)(N+)(=O)(O)
COc1cccc(c1OS(=O)(=O)c1ccc(cc1)C)C=NNC(=O)c1cccc(c1)(N+)(=O)(O)
InChI=1SC22H19N3O7Sc11591119(121015)33(2930)322117(64820(21)312)14232422(26)1653718(1316)25(27)28h314H12H3(H2426)b2314+
MFCD02608809
ZINC000002077243
ZINC15986005
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