Vitas-M small molecule compound

ethyl 2-{[(1,3-dimethyl-1H-pyrazol-4-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK334319
SMILES CCOC(=O)c1c(NC(=O)c2cn(nc2C)C)sc2c1CCCC2

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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 C17H21N3O3S MW 347.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O3S/c1-4-23-17(22)14-11-7-5-6-8-13(11)24-16(14)18-15(21)12-9-20(3)19-10(12)2/h9H,4-8H2,1-3H3,(H,18,21)
InChIKey
GVZKVURKMOURES-UHFFFAOYSA-N
Synonyms
514220-39-4
514220394
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CN(N=C3C)C
ethyl2(((13dimethyl1Hpyrazol4yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((13dimethylpyrazole4carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC17H21N3O3Sc142317(22)1411756813(11)2416(14)1815(21)12920(3)1910(12)2h9H48H213H3(H1821)
MFCD01921893
ZINC000002750039
ZINC02750039
ZINC2750039

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Available files

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