Vitas-M small molecule compound
(2E)-N-(4-ethoxybenzyl)-2-{3-methoxy-4-[(2,3,4,6-tetra-O-acetylhexopyranosyl)oxy]benzylidene}hydrazinecarbothioamide
Catalog ID
STL058642
SMILES CCOc1ccc(cc1)CNC(=S)N/N=C/c1ccc(c(c1)OC)OC1OC(COC(=O)C)C(C(C1OC(=O)C)OC(=O)C)OC(=O)C
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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 C32H39N3O12S MW 689.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H39N3O12S/c1-7-41-24-11-8-22(9-12-24)15-33-32(48)35-34-16-23-10-13-25(26(14-23)40-6)46-31-30(45-21(5)39)29(44-20(4)38)28(43-19(3)37)27(47-31)17-42-18(2)36/h8-14,16,27-31H,7,15,17H2,1-6H3,(H2,33,35,48)/b34-16+InChIKey
LMEYGSGIHMKOPL-AABVJFSESA-NSynonyms
(2E)N(4ethoxybenzyl)2(3methoxy4((2346tetraOacetylhexopyranosyl)oxy)benzylidene)hydrazinecarbothioamide
(2R3S4S5R6R)2(acetoxymethyl)6(4((E)(2((4ethoxybenzyl)carbamothioyl)hydrazono)methyl)2methoxyphenoxy)tetrahydro2Hpyran345triyltriacetate
(345triacetyloxy6(4((E)((4ethoxyphenyl)methylcarbamothioylhydrazinylidene)methyl)2methoxyphenoxy)oxan2yl)methylacetate
CCOC1=CC=C(C=C1)CNC(=S)NN=CC2=CC(=C(C=C2)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC
CCOc1ccc(cc1)CNC(=S)NN=Cc1ccc(c(c1)OC)OC1O(C@H)(COC(=O)C)(C@@H)((C@@H)((C@H)1OC(=O)C)OC(=O)C)OC(=O)C
CCOc1ccc(cc1)CNC(=S)NN=Cc1ccc(c(c1)OC)OC1OC(COC(=O)C)C(C(C1OC(=O)C)OC(=O)C)OC(=O)C
InChI=1SC32H39N3O12Sc17412411822(91224)153332(48)35341623101325(26(1423)406)463130(4521(5)39)29(4420(4)38)28(4319(3)37)27(4731)174218(2)36h814162731H71517H216H3(H2333548)b3416+
MFCD00573813
ZINC000253531293
ZINC000253531294
Check stock
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