Vitas-M small molecule compound

ethyl (2E)-2-{[(4,7-dimethoxy-1H-indol-2-yl)carbonyl]imino}-2,3-dihydro-1,3-thiazole-4-carboxylate

Catalog ID
STL409187
SMILES CCOC(=O)c1cs/c(=N/C(=O)c2[nH]c3c(c2)c(OC)ccc3OC)/[nH]1

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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 C17H17N3O5S MW 375.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O5S/c1-4-25-16(22)11-8-26-17(19-11)20-15(21)10-7-9-12(23-2)5-6-13(24-3)14(9)18-10/h5-8,18H,4H2,1-3H3,(H,19,20,21)
InChIKey
YNWXOBSQFZCOJN-UHFFFAOYSA-N
Synonyms
1574495-22-9
1574495229
CCOC(=O)C1=CSC(=N1)NC(=O)C2=CC3=C(C=CC(=C3N2)OC)OC
CCOC(=O)c1csc(=NC(=O)c2(nH)c3c(c2)c(OC)ccc3OC)(nH)1
ethyl(2E)2(((47dimethoxy1Hindol2yl)carbonyl)imino)23dihydro13thiazole4carboxylate
ethyl2((47dimethoxy1Hindole2carbonyl)amino)13thiazole4carboxylate
InChI=1SC17H17N3O5Sc142516(22)1182617(1911)2015(21)107912(232)5613(243)14(9)1810h5818H4H213H3(H192021)
MFCD30705585
ZINC000096117211
ZINC96117211

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Available files

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