Vitas-M small molecule compound
S-benzyl-N~2~-{[(4-butyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-N-propan-2-yl-L-cysteinamide
Catalog ID
STK604491
SMILES CCCCc1cc(=O)oc2c1ccc(c2C)OCC(=O)N[C@H](C(=O)NC(C)C)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 C29H36N2O5S MW 524.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H36N2O5S/c1-5-6-12-22-15-27(33)36-28-20(4)25(14-13-23(22)28)35-16-26(32)31-24(29(34)30-19(2)3)18-37-17-21-10-8-7-9-11-21/h7-11,13-15,19,24H,5-6,12,16-18H2,1-4H3,(H,30,34)(H,31,32)/t24-/m0/s1InChIKey
AXGPQQQQJIECIF-DEOSSOPVSA-NSynonyms
1013751-81-9(2R)3benzylsulfanyl2((2(4butyl8methyl2oxochromen7yl)oxyacetyl)amino)Npropan2ylpropanamide
(R)3(benzylthio)2(2((4butyl8methyl2oxo2Hchromen7yl)oxy)acetamido)Nisopropylpropanamide
1013751819
CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC(=O)NC(CSCC3=CC=CC=C3)C(=O)NC(C)C
CCCCc1cc(=O)oc2c1ccc(c2C)OCC(=O)N(C@H)(C(=O)NC(C)C)CSCc1ccccc1
InChI=1SC29H36N2O5Sc15612221527(33)362820(4)25(141323(22)28)351626(32)3124(29(34)3019(2)3)18371721108791121h71113151924H56121618H214H3(H3034)(H3132)t24m0s1
MFCD08289105
SbenzylN~2~(((4butyl8methyl2oxo2Hchromen7yl)oxy)acetyl)Npropan2ylLcysteinamide
SBENZYLN2(((4BUTYL8METHYL2OXO2HCHROMEN7YL)OXY)ACETYL)NPROPAN2YLLCYSTEINAMIDE
ZINC000009410135
ZINC09410135
ZINC9410135
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.