Vitas-M small molecule compound
ethyl 2-[({2-[2-(1,3-benzodioxol-5-yloxy)propanoyl]hydrazinyl}carbonothioyl)amino]-5-benzylthiophene-3-carboxylate
Catalog ID
STK437276
SMILES CCOC(=O)c1cc(sc1NC(=S)NNC(=O)C(Oc1ccc2c(c1)OCO2)C)Cc1ccccc1
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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 C25H25N3O6S2 MW 527.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O6S2/c1-3-31-24(30)19-13-18(11-16-7-5-4-6-8-16)36-23(19)26-25(35)28-27-22(29)15(2)34-17-9-10-20-21(12-17)33-14-32-20/h4-10,12-13,15H,3,11,14H2,1-2H3,(H,27,29)(H2,26,28,35)InChIKey
XDTRMQMUASDNKM-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NNC(=O)C(C)OC3=CC4=C(C=C3)OCO4
ETHYL2((((2(2HBENZO(34D)13DIOXOLAN5YLOXY)PROPANOYLAMINO)AMINO)THIOXOMETHYL)AMINO)5BENZYLTHIOPHENE3CARBOXYLATE
ethyl2(((2(2(13benzodioxol5yloxy)propanoyl)hydrazinyl)carbonothioyl)amino)5benzylthiophene3carboxylate
ETHYL2((2(13BENZODIOXOL5YLOXY)PROPANOYLAMINO)CARBAMOTHIOYLAMINO)5BENZYLTHIOPHENE3CARBOXYLATE
InChI=1SC25H25N3O6S2c133124(30)191318(11167546816)3623(19)2625(35)282722(29)15(2)34179102021(1217)33143220h410121315H31114H212H3(H2729)(H2262835)
MFCD03944744
ZINC000059602972
ZINC000059602974
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