Vitas-M small molecule compound

S-benzyl-N-{[(3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-L-cysteine

Catalog ID
STL531417
SMILES O=C(N[C@H](C(=O)O)CSCc1ccccc1)COc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1

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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 C29H27NO6S MW 517.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27NO6S/c1-19-23-13-12-22(15-26(23)36-29(34)24(19)14-20-8-4-2-5-9-20)35-16-27(31)30-25(28(32)33)18-37-17-21-10-6-3-7-11-21/h2-13,15,25H,14,16-18H2,1H3,(H,30,31)(H,32,33)/t25-/m0/s1
InChIKey
XDWFPOZICRATHJ-VWLOTQADSA-N
Synonyms
956048-94-5
(2~(R))2((2(3benzyl4methyl2oxochromen7yl)oxyacetyl)amino)3benzylsulfanylpropanoicacid
(2R)2((2(3BENZYL4METHYL2OXOCHROMEN7YL)OXYACETYL)AMINO)3BENZYLSULFANYLPROPANOICACID
(R)2(2((3BENZYL4METHYL2OXO2HCHROMEN7YL)OXY)ACETAMIDO)3(BENZYLTHIO)PROPANOICACID
1806315
956048945
InChI=1SC29H27NO6Sc11923131222(1526(23)3629(34)24(19)14208425920)351627(31)3025(28(32)33)18371721106371121h2131525H141618H21H3(H3031)(H3233)t25m0s1
O=C(N(C@H)(C(=O)O)CSCc1ccccc1)COc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1
SbenzylN(((3benzyl4methyl2oxo2Hchromen7yl)oxy)acetyl)Lcysteine
ZINC000002158408
ZINC2158408

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Available files

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