Vitas-M small molecule compound

ethyl 2-{[(1-acetylpiperidin-4-yl)carbonyl]amino}-5-phenylthiophene-3-carboxylate

Catalog ID
STK481072
SMILES CCOC(=O)c1cc(sc1NC(=O)C1CCN(CC1)C(=O)C)c1ccccc1

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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 C21H24N2O4S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4S/c1-3-27-21(26)17-13-18(15-7-5-4-6-8-15)28-20(17)22-19(25)16-9-11-23(12-10-16)14(2)24/h4-8,13,16H,3,9-12H2,1-2H3,(H,22,25)
InChIKey
IROSYPZGYMYBMV-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C3CCN(CC3)C(=O)C
ethyl2(((1acetylpiperidin4yl)carbonyl)amino)5phenylthiophene3carboxylate
ETHYL2((1ACETYL(4PIPERIDYL))CARBONYLAMINO)5PHENYLTHIOPHENE3CARBOXYLATE
ETHYL2((1ACETYLPIPERIDINE4CARBONYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC21H24N2O4Sc132721(26)171318(157546815)2820(17)2219(25)1691123(121016)14(2)24h481316H3912H212H3(H2225)
MFCD08071687
ZINC000006729842
ZINC06729842
ZINC6729842

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Available files

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