Vitas-M small molecule compound

[5-(4-ethoxyphenyl)-1H-pyrazol-3-yl](thiomorpholin-4-yl)methanone

Catalog ID
STK985024
SMILES CCOc1ccc(cc1)c1[nH]nc(c1)C(=O)N1CCSCC1

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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 C16H19N3O2S MW 317.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O2S/c1-2-21-13-5-3-12(4-6-13)14-11-15(18-17-14)16(20)19-7-9-22-10-8-19/h3-6,11H,2,7-10H2,1H3,(H,17,18)
InChIKey
GCMCNHSERCCGHY-UHFFFAOYSA-N
Synonyms

(3(4ethoxyphenyl)1Hpyrazol5yl)thiomorpholin4ylmethanone
(5(4ethoxyphenyl)1Hpyrazol3yl)(thiomorpholin4yl)methanone
CCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N3CCSCC3
CCOc1ccc(cc1)c1(nH)nc(c1)C(=O)N1CCSCC1
InChI=1SC16H19N3O2Sc1221135312(4613)141115(181714)16(20)19792210819h3611H2710H21H3(H1718)
MFCD18182062
ZINC000051315713
ZINC51315713

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Available files

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