Vitas-M small molecule compound

6-{[(1,1-dioxidotetrahydrothiophen-3-yl)sulfanyl]methyl}-N-(2-phenylethyl)-1,3,5-triazine-2,4-diamine

Catalog ID
STK737058
SMILES Nc1nc(NCCc2ccccc2)nc(n1)CSC1CCS(=O)(=O)C1

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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 C16H21N5O2S2 MW 379.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N5O2S2/c17-15-19-14(10-24-13-7-9-25(22,23)11-13)20-16(21-15)18-8-6-12-4-2-1-3-5-12/h1-5,13H,6-11H2,(H3,17,18,19,20,21)
InChIKey
BHDUJGORMFKRKB-UHFFFAOYSA-N
Synonyms

6(((11dioxidotetrahydrothiophen3yl)sulfanyl)methyl)N(2phenylethyl)135triazine24diamine
6((11dioxothiolan3yl)sulfanylmethyl)2N(2phenylethyl)135triazine24diamine
6((11DIOXOTHIOLAN3YL)SULFANYLMETHYL)2NPHENETHYL135TRIAZINE24DIAMINE
C1CS(=O)(=O)CC1SCC2=NC(=NC(=N2)NCCC3=CC=CC=C3)N
InChI=1SC16H21N5O2S2c17151914(1024137925(2223)1113)2016(2115)1886124213512h1513H611H2(H31718192021)
MFCD05260484
ZINC000004512158
ZINC000004512159

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Available files

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