Vitas-M small molecule compound

N-[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]cyclohexanecarboxamide

Catalog ID
STL088724
SMILES O=C(C1CCCCC1)Nc1cc(ccc1C)c1nc2c(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 C21H22N2OS MW 350.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2OS/c1-14-11-12-16(21-23-17-9-5-6-10-19(17)25-21)13-18(14)22-20(24)15-7-3-2-4-8-15/h5-6,9-13,15H,2-4,7-8H2,1H3,(H,22,24)
InChIKey
ZWVSLQPCMUKHRC-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=O)C4CCCCC4
InChI=1SC21H22N2OSc114111216(2123179561019(17)2521)1318(14)2220(24)157324815h5691315H2478H21H3(H2224)
MFCD07579399
N(5(13benzothiazol2yl)2methylphenyl)cyclohexanecarboxamide
ZINC000041107640
ZINC41107640

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Available files

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