Vitas-M small molecule compound
4-bromo-2-[(E)-{[3-(tert-butoxycarbonyl)-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl]imino}methyl]phenolate
Catalog ID
STL047321
SMILES C[NH+]1CCc2c(C1)sc(c2C(=O)OC(C)(C)C)/N=C/c1cc(Br)ccc1[O-]
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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 C20H23BrN2O3S MW 451.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23BrN2O3S/c1-20(2,3)26-19(25)17-14-7-8-23(4)11-16(14)27-18(17)22-10-12-9-13(21)5-6-15(12)24/h5-6,9-10,24H,7-8,11H2,1-4H3/b22-10+InChIKey
CITKIFGYQGCMFI-LSHDLFTRSA-NSynonyms
362481-33-2362481332
4bromo2((E)((3(tertbutoxycarbonyl)6methyl4567tetrahydrothieno(23c)pyridin6ium2yl)imino)methyl)phenolate
C(NH+)1CCc2c(C1)sc(c2C(=O)OC(C)(C)C)N=Cc1cc(Br)ccc1(O)
MFCD01147668
ZINC000001820078
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