Vitas-M small molecule compound
benzyl N-{(2E)-3-(4-{[(4-methylphenyl)sulfonyl]oxy}phenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}alaninate
Catalog ID
STK700477
SMILES O=C(C(NC(=O)/C(=C\c1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)/NC(=O)c1ccccc1)C)OCc1ccccc1
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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 C33H30N2O7S MW 598.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30N2O7S/c1-23-13-19-29(20-14-23)43(39,40)42-28-17-15-25(16-18-28)21-30(35-31(36)27-11-7-4-8-12-27)32(37)34-24(2)33(38)41-22-26-9-5-3-6-10-26/h3-21,24H,22H2,1-2H3,(H,34,37)(H,35,36)/b30-21+InChIKey
RNMHEQBGZSVNBM-MWAVMZGNSA-NSynonyms
(E)benzyl2(2benzamido3(4(tosyloxy)phenyl)acrylamido)propanoate
BENZYL2(((E)2BENZAMIDO3(4(4METHYLPHENYL)SULFONYLOXYPHENYL)PROP2ENOYL)AMINO)PROPANOATE
benzylN((2E)3(4(((4methylphenyl)sulfonyl)oxy)phenyl)2((phenylcarbonyl)amino)prop2enoyl)alaninate
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=C(C(=O)NC(C)C(=O)OCC3=CC=CC=C3)NC(=O)C4=CC=CC=C4
InChI=1SC33H30N2O7Sc123131929(201423)43(3940)4228171525(161828)2130(3531(36)27117481227)32(37)3424(2)33(38)41222695361026h32124H22H212H3(H3437)(H3536)b3021+
MFCD01853183
O=C(C(NC(=O)C(=Cc1ccc(cc1)OS(=O)(=O)c1ccc(cc1)C)NC(=O)c1ccccc1)C)OCc1ccccc1
ZINC000097968829
ZINC000097968830
Check stock
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Check stock on Vitas-MAvailable files
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