Vitas-M small molecule compound

2-(1,3-benzothiazol-2-ylsulfanyl)-N-cycloheptylacetamide

Catalog ID
STK220092
SMILES O=C(NC1CCCCCC1)CSc1nc2c(s1)cccc2

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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 C16H20N2OS2 MW 320.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2OS2/c19-15(17-12-7-3-1-2-4-8-12)11-20-16-18-13-9-5-6-10-14(13)21-16/h5-6,9-10,12H,1-4,7-8,11H2,(H,17,19)
InChIKey
JRERUYXNTKGFKJ-UHFFFAOYSA-N
Synonyms
455295-05-3
2(13BENZOTHIAZOL2YLSULFANYL)NCYCLOHEPTYLACETAMIDE
2(benzo(d)thiazol2ylthio)Ncycloheptylacetamide
2BENZOTHIAZOL2YLTHIONCYCLOHEPTYLACETAMIDE
455295053
C1CCCC(CC1)NC(=O)CSC2=NC3=CC=CC=C3S2
InChI=1SC16H20N2OS2c1915(171273124812)11201618139561014(13)2116h5691012H147811H2(H1719)
MFCD03196565
ZINC000000554459
ZINC00554459
ZINC554459

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Available files

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