Vitas-M small molecule compound
diethyl 5,5'-[6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole-2,4-diylbis(sulfanediylmethanediyl)]difuran-2-carboxylate
Catalog ID
STK532668
SMILES CCOC(=O)c1ccc(o1)CSc1nc(SCc2ccc(o2)C(=O)OCC)c2c(n1)[nH]c1c2CCCC1
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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 C26H27N3O6S2 MW 541.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O6S2/c1-3-32-24(30)19-11-9-15(34-19)13-36-23-21-17-7-5-6-8-18(17)27-22(21)28-26(29-23)37-14-16-10-12-20(35-16)25(31)33-4-2/h9-12H,3-8,13-14H2,1-2H3,(H,27,28,29)InChIKey
QGXYZYXDBRLTOP-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(O1)CSC2=NC(=NC3=C2C4=C(N3)CCCC4)SCC5=CC=C(O5)C(=O)OCC
CCOC(=O)c1ccc(o1)CSc1nc(SCc2ccc(o2)C(=O)OCC)c2c(n1)(nH)c1c2CCCC1
diethyl55(((6789tetrahydro5Hpyrimido(45b)indole24diyl)bis(sulfanediyl))bis(methylene))bis(furan2carboxylate)
diethyl55(6789tetrahydro5Hpyrimido(45b)indole24diylbis(sulfanediylmethanediyl))difuran2carboxylate
ethyl5((2((5ethoxycarbonylfuran2yl)methylsulfanyl)6789tetrahydro5Hpyrimido(45b)indol4yl)sulfanylmethyl)furan2carboxylate
InChI=1SC26H27N3O6S2c133224(30)1911915(3419)1336232117756818(17)2722(21)2826(2923)371416101220(3516)25(31)3342h912H381314H212H3(H272829)
MFCD02993595
ZINC000002117744
ZINC02117744
ZINC2117744
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