Vitas-M small molecule compound

3-cyclohexyl-N-[6-(methylsulfonyl)-1,3-benzothiazol-2-yl]propanamide

Catalog ID
STK417567
SMILES O=C(Nc1nc2c(s1)cc(cc2)S(=O)(=O)C)CCC1CCCCC1

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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 C17H22N2O3S2 MW 366.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O3S2/c1-24(21,22)13-8-9-14-15(11-13)23-17(18-14)19-16(20)10-7-12-5-3-2-4-6-12/h8-9,11-12H,2-7,10H2,1H3,(H,18,19,20)
InChIKey
PBPYYCYUWIUOAZ-UHFFFAOYSA-N
Synonyms
438616-78-5
3cyclohexylN(6(methylsulfonyl)13benzothiazol2yl)propanamide
3CYCLOHEXYLN(6METHYLSULFONYL13BENZOTHIAZOL2YL)PROPANAMIDE
438616785
CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CCC3CCCCC3
InChI=1SC17H22N2O3S2c124(2122)13891415(1113)2317(1814)1916(20)107125324612h891112H2710H21H3(H181920)
MFCD01919619
ZINC000000997932
ZINC00997932
ZINC997932

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Available files

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