Vitas-M small molecule compound

S-benzyl-N-{[(3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl)oxy]acetyl}-L-cysteine

Catalog ID
STL534257
SMILES O=C(N[C@H](C(=O)O)CSCc1ccccc1)COc1cc(C)cc2c1c(C)c(c(=O)o2)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 C30H29NO6S MW 531.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29NO6S/c1-19-13-25(28-20(2)23(30(35)37-26(28)14-19)15-21-9-5-3-6-10-21)36-16-27(32)31-24(29(33)34)18-38-17-22-11-7-4-8-12-22/h3-14,24H,15-18H2,1-2H3,(H,31,32)(H,33,34)/t24-/m0/s1
InChIKey
YJYQFVAYKWTSMX-DEOSSOPVSA-N
Synonyms
956962-59-7
(2~(R))2((2(3benzyl47dimethyl2oxochromen5yl)oxyacetyl)amino)3benzylsulfanylpropanoicacid
(2R)2((2(3BENZYL47DIMETHYL2OXOCHROMEN5YL)OXYACETYL)AMINO)3BENZYLSULFANYLPROPANOICACID
(R)2(2((3BENZYL47DIMETHYL2OXO2HCHROMEN5YL)OXY)ACETAMIDO)3(BENZYLTHIO)PROPANOICACID
1774376
956962597
InChI=1SC30H29NO6Sc1191325(2820(2)23(30(35)3726(28)1419)152195361021)361627(32)3124(29(33)34)18381722117481222h31424H1518H212H3(H3132)(H3334)t24m0s1
O=C(N(C@H)(C(=O)O)CSCc1ccccc1)COc1cc(C)cc2c1c(C)c(c(=O)o2)Cc1ccccc1
SbenzylN(((3benzyl47dimethyl2oxo2Hchromen5yl)oxy)acetyl)Lcysteine
ZINC000002119508
ZINC2119508

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Available files

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