Vitas-M small molecule compound
N-{[3-(4-bromophenyl)-5-methyl-7-oxo-7H-furo[3,2-g]chromen-6-yl]acetyl}-S-methyl-D-cysteine
Catalog ID
STL463451
SMILES CSC[C@H](C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Br
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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 C24H20BrNO6S MW 530.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrNO6S/c1-12-15-7-17-18(13-3-5-14(25)6-4-13)10-31-20(17)9-21(15)32-24(30)16(12)8-22(27)26-19(11-33-2)23(28)29/h3-7,9-10,19H,8,11H2,1-2H3,(H,26,27)(H,28,29)/t19-/m1/s1InChIKey
WWIHRFCFRMBMIG-LJQANCHMSA-NSynonyms
(2S)2((2(3(4bromophenyl)5methyl7oxofuro(32g)chromen6yl)acetyl)amino)3methylsulfanylpropanoicacid
(R)2(2(3(4bromophenyl)5methyl7oxo7Hfuro(32g)chromen6yl)acetamido)3(methylthio)propanoicacid
CC1=C(C(=O)OC2=C1C=C3C(=C2)OC=C3C4=CC=C(C=C4)Br)CC(=O)NC(CSC)C(=O)O
CSC(C@@H)(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Br
CSC(C@H)(C(=O)O)NC(=O)Cc1c(=O)oc2c(c1C)cc1c(c2)occ1c1ccc(cc1)Br
InChI=1SC24H20BrNO6Sc1121571718(133514(25)6413)103120(17)921(15)3224(30)16(12)822(27)2619(11332)23(28)29h3791019H811H212H3(H2627)(H2829)t19m1s1
MFCD06493042
N((3(4bromophenyl)5methyl7oxo7Hfuro(32g)chromen6yl)acetyl)SmethylDcysteine
ZINC000101968859
ZINC101968859
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.