Vitas-M small molecule compound

5-butyl-1-(2-methylphenyl)-1,3,5-triazinane-2-thione

Catalog ID
STL176732
SMILES CCCCN1CNC(=S)N(C1)c1ccccc1C

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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 C14H21N3S MW 263.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H21N3S/c1-3-4-9-16-10-15-14(18)17(11-16)13-8-6-5-7-12(13)2/h5-8H,3-4,9-11H2,1-2H3,(H,15,18)
InChIKey
LXJVNLVGLJZLQN-UHFFFAOYSA-N
Synonyms
678190-31-3
5butyl1(2methylphenyl)135triazinane2thione
678190313
CCCCN1CNC(=S)N(C1)C2=CC=CC=C2C
InChI=1SC14H21N3Sc134916101514(18)17(1116)13865712(13)2h58H34911H212H3(H1518)
MFCD03673325
ZINC000020384730
ZINC20384730

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Available files

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