Vitas-M small molecule compound

ethyl 1-[N-(3,5-dimethylphenyl)-N-(methylsulfonyl)alanyl]piperidine-4-carboxylate

Catalog ID
STL071747
SMILES CCOC(=O)C1CCN(CC1)C(=O)C(N(S(=O)(=O)C)c1cc(C)cc(c1)C)C

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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 C20H30N2O5S MW 410.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H30N2O5S/c1-6-27-20(24)17-7-9-21(10-8-17)19(23)16(4)22(28(5,25)26)18-12-14(2)11-15(3)13-18/h11-13,16-17H,6-10H2,1-5H3
InChIKey
AVNJXNQGEWYFLL-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1CCN(CC1)C(=O)C(C)N(C2=CC(=CC(=C2)C)C)S(=O)(=O)C
ETHYL1(2(35DIMETHYLNMETHYLSULFONYLANILINO)PROPANOYL)PIPERIDINE4CARBOXYLATE
ethyl1(N(35dimethylphenyl)N(methylsulfonyl)alanyl)piperidine4carboxylate
ETHYL1(N(35DIMETHYLPHENYL)N(METHYLSULFONYL)LALANYL)PIPERIDINE4CARBOXYLATE
InChI=1SC20H30N2O5Sc162720(24)177921(10817)19(23)16(4)22(28(525)26)181214(2)1115(3)1318h11131617H610H215H3
MFCD06624259
ZINC000002872218
ZINC000002872219

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Available files

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