Vitas-M small molecule compound
4-[(E)-{2-[(3-bromophenyl)carbonyl]hydrazinylidene}methyl]-2-ethoxyphenyl 4-methylbenzenesulfonate
Catalog ID
STK378595
SMILES CCOc1cc(/C=N/NC(=O)c2cccc(c2)Br)ccc1OS(=O)(=O)c1ccc(cc1)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 C23H21BrN2O5S MW 517.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN2O5S/c1-3-30-22-13-17(15-25-26-23(27)18-5-4-6-19(24)14-18)9-12-21(22)31-32(28,29)20-10-7-16(2)8-11-20/h4-15H,3H2,1-2H3,(H,26,27)/b25-15+InChIKey
BVJLQQYCQVAFGZ-MFKUBSTISA-NSynonyms
(4((E)((3bromobenzoyl)hydrazinylidene)methyl)2ethoxyphenyl)4methylbenzenesulfonate
4((1E)2((3BROMOPHENYL)CARBONYLAMINO)2AZAVINYL)2ETHOXYPHENYL4METHYLBENZENESULFONATE
4((E)(2((3bromophenyl)carbonyl)hydrazinylidene)methyl)2ethoxyphenyl4methylbenzenesulfonate
CCOC1=C(C=CC(=C1)C=NNC(=O)C2=CC(=CC=C2)Br)OS(=O)(=O)C3=CC=C(C=C3)C
CCOc1cc(C=NNC(=O)c2cccc(c2)Br)ccc1OS(=O)(=O)c1ccc(cc1)C
InChI=1SC23H21BrN2O5Sc1330221317(15252623(27)1854619(24)1418)91221(22)3132(2829)2010716(2)81120h415H3H212H3(H2627)b2515+
MFCD01874099
ZINC000008843044
ZINC34380162
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