Vitas-M small molecule compound

S-benzyl-N-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)acetyl]-L-cysteine

Catalog ID
STL530953
SMILES O=C(Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)N[C@H](C(=O)O)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 C22H20ClNO6S MW 461.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClNO6S/c1-12-14-7-16(23)18(25)9-19(14)30-22(29)15(12)8-20(26)24-17(21(27)28)11-31-10-13-5-3-2-4-6-13/h2-7,9,17,25H,8,10-11H2,1H3,(H,24,26)(H,27,28)/t17-/m0/s1
InChIKey
LKUCMBCSRHWARF-KRWDZBQOSA-N
Synonyms
956626-88-3
(2~(R))3benzylsulfanyl2((2(6chloro7hydroxy4methyl2oxochromen3yl)acetyl)amino)propanoicacid
(2R)3BENZYLSULFANYL2((2(6CHLORO7HYDROXY4METHYL2OXOCHROMEN3YL)ACETYL)AMINO)PROPANOICACID
(R)3(BENZYLTHIO)2(2(6CHLORO7HYDROXY4METHYL2OXO2HCHROMEN3YL)ACETAMIDO)PROPANOICACID
6851297
956626883
InChI=1SC22H20ClNO6Sc11214716(23)18(25)919(14)3022(29)15(12)820(26)2417(21(27)28)113110135324613h2791725H81011H21H3(H2426)(H2728)t17m0s1
O=C(Cc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)N(C@H)(C(=O)O)CSCc1ccccc1
SbenzylN((6chloro7hydroxy4methyl2oxo2Hchromen3yl)acetyl)Lcysteine
ZINC000002123440
ZINC2123440

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Available files

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