Vitas-M small molecule compound
S-benzyl-N~2~-{[(4-ethyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-N-(3-hydroxypropyl)-L-cysteinamide
Catalog ID
STK601772
SMILES OCCCNC(=O)[C@@H](NC(=O)COc1ccc2c(c1C)oc(=O)cc2CC)CSCc1ccccc1
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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 C27H32N2O6S MW 512.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O6S/c1-3-20-14-25(32)35-26-18(2)23(11-10-21(20)26)34-15-24(31)29-22(27(33)28-12-7-13-30)17-36-16-19-8-5-4-6-9-19/h4-6,8-11,14,22,30H,3,7,12-13,15-17H2,1-2H3,(H,28,33)(H,29,31)/t22-/m0/s1InChIKey
GQKUWPWYOOBXER-QFIPXVFZSA-NSynonyms
955918-77-1(2R)3benzylsulfanyl2((2(4ethyl8methyl2oxochromen7yl)oxyacetyl)amino)N(3hydroxypropyl)propanamide
(R)3(benzylthio)2(2((4ethyl8methyl2oxo2Hchromen7yl)oxy)acetamido)N(3hydroxypropyl)propanamide
955918771
CCC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)NC(CSCC3=CC=CC=C3)C(=O)NCCCO
InChI=1SC27H32N2O6Sc13201425(32)352618(2)23(111021(20)26)341524(31)2922(27(33)281271330)173616198546919h46811142230H3712131517H212H3(H2833)(H2931)t22m0s1
MFCD08745187
OCCCNC(=O)(C@@H)(NC(=O)COc1ccc2c(c1C)oc(=O)cc2CC)CSCc1ccccc1
SbenzylN~2~(((4ethyl8methyl2oxo2Hchromen7yl)oxy)acetyl)N(3hydroxypropyl)Lcysteinamide
SBENZYLN2(((4ETHYL8METHYL2OXO2HCHROMEN7YL)OXY)ACETYL)N(3HYDROXYPROPYL)LCYSTEINAMIDE
ZINC000009183753
ZINC09183753
ZINC9183753
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.