Vitas-M small molecule compound

2-({(2E)-3-(4-{[(4-methylphenyl)sulfonyl]oxy}phenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}amino)ethyl acetate

Catalog ID
STK700226
SMILES CC(=O)OCCNC(=O)/C(=C\c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/NC(=O)c1ccccc1

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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 C27H26N2O7S MW 522.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O7S/c1-19-8-14-24(15-9-19)37(33,34)36-23-12-10-21(11-13-23)18-25(27(32)28-16-17-35-20(2)30)29-26(31)22-6-4-3-5-7-22/h3-15,18H,16-17H2,1-2H3,(H,28,32)(H,29,31)/b25-18+
InChIKey
GCYPLMQGBGUJEM-XIEYBQDHSA-N
Synonyms
371952-53-3
(E)2(2benzamido3(4(tosyloxy)phenyl)acrylamido)ethylacetate
2(((2E)3(4(((4methylphenyl)sulfonyl)oxy)phenyl)2((phenylcarbonyl)amino)prop2enoyl)amino)ethylacetate
2(((E)2BENZAMIDO3(4(4METHYLPHENYL)SULFONYLOXYPHENYL)PROP2ENOYL)AMINO)ETHYLACETATE
371952533
CC(=O)OCCNC(=O)C(=Cc1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)NC(=O)c1ccccc1
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=C(C(=O)NCCOC(=O)C)NC(=O)C3=CC=CC=C3
InChI=1SC27H26N2O7Sc11981424(15919)37(3334)3623121021(111323)1825(27(32)2816173520(2)30)2926(31)226435722h31518H1617H212H3(H2832)(H2931)b2518+
MFCD01858246
ZINC000009034297
ZINC09034297
ZINC9034297

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Available files

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