Vitas-M small molecule compound

2,2'-(5-butyl-1,3,5-triazinane-1,3-diyl)bis(1,3-benzothiazole)

Catalog ID
STK508619
SMILES CCCCN1CN(CN(C1)c1nc2c(s1)cccc2)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 C21H23N5S2 MW 409.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5S2/c1-2-3-12-24-13-25(20-22-16-8-4-6-10-18(16)27-20)15-26(14-24)21-23-17-9-5-7-11-19(17)28-21/h4-11H,2-3,12-15H2,1H3
InChIKey
WOSGNLAGAKLKFE-UHFFFAOYSA-N
Synonyms

2(3(13BENZOTHIAZOL2YL)5BUTYL135TRIAZINAN1YL)13BENZOTHIAZOLE
22(5butyl135triazinane13diyl)bis(13benzothiazole)
CCCCN1CN(CN(C1)C2=NC3=CC=CC=C3S2)C4=NC5=CC=CC=C5S4
InChI=1SC21H23N5S2c12312241325(2022168461018(16)2720)1526(1424)2123179571119(17)2821h411H231215H21H3
MFCD06192569
ZINC000057396317
ZINC57396317

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Available files

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