Vitas-M small molecule compound

ethyl 2-[({2-[(1,3-benzodioxol-5-yloxy)acetyl]hydrazinyl}carbonothioyl)amino]-5-benzylthiophene-3-carboxylate

Catalog ID
STK437156
SMILES CCOC(=O)c1cc(sc1NC(=S)NNC(=O)COc1ccc2c(c1)OCO2)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 C24H23N3O6S2 MW 513.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O6S2/c1-2-30-23(29)18-12-17(10-15-6-4-3-5-7-15)35-22(18)25-24(34)27-26-21(28)13-31-16-8-9-19-20(11-16)33-14-32-19/h3-9,11-12H,2,10,13-14H2,1H3,(H,26,28)(H2,25,27,34)
InChIKey
BGNCFUOVCJZNKM-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1)CC2=CC=CC=C2)NC(=S)NNC(=O)COC3=CC4=C(C=C3)OCO4
ETHYL2((((2(2HBENZO(34D)13DIOXOLAN5YLOXY)ACETYLAMINO)AMINO)THIOXOMETHYL)AMINO)5BENZYLTHIOPHENE3CARBOXYLATE
ethyl2(((2((13benzodioxol5yloxy)acetyl)hydrazinyl)carbonothioyl)amino)5benzylthiophene3carboxylate
ETHYL2(((2(13BENZODIOXOL5YLOXY)ACETYL)AMINO)CARBAMOTHIOYLAMINO)5BENZYLTHIOPHENE3CARBOXYLATE
InChI=1SC24H23N3O6S2c123023(29)181217(10156435715)3522(18)2524(34)272621(28)133116891920(1116)33143219h391112H2101314H21H3(H2628)(H2252734)
MFCD03944743
ZINC000020168661
ZINC20168661

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.