Vitas-M small molecule compound

2-{[(2E)-6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2(3H)-ylidene]amino}-2-oxoethyl cyclohexyl(methyl)carbamodithioate

Catalog ID
STK560574
SMILES CC1CCc2c(C1)s/c(=N/C(=O)CSC(=S)N(C1CCCCC1)C)/[nH]2

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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 C18H27N3OS3 MW 397.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27N3OS3/c1-12-8-9-14-15(10-12)25-17(19-14)20-16(22)11-24-18(23)21(2)13-6-4-3-5-7-13/h12-13H,3-11H2,1-2H3,(H,19,20,22)
InChIKey
SEJGOVLKAMUSSG-UHFFFAOYSA-N
Synonyms
674307-70-1
2(((2E)6methyl4567tetrahydro13benzothiazol2(3H)ylidene)amino)2oxoethylcyclohexyl(methyl)carbamodithioate
CC1CCc2c(C1)sc(=NC(=O)CSC(=S)N(C1CCCCC1)C)(nH)2
MFCD04081781
ZINC000004680242
ZINC000004680243

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Available files

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