Vitas-M small molecule compound

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

Catalog ID
STK167051
SMILES COc1ccccc1Nc1nc(CSc2nnc(s2)N)nc(n1)N

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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 C13H14N8OS2 MW 362.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N8OS2/c1-22-8-5-3-2-4-7(8)16-12-18-9(17-10(14)19-12)6-23-13-21-20-11(15)24-13/h2-5H,6H2,1H3,(H2,15,20)(H3,14,16,17,18,19)
InChIKey
PTGDBYAQJCOETB-UHFFFAOYSA-N
Synonyms
669744-34-7
(4AMINO6((5AMINO(134THIADIAZOL2YLTHIO))METHYL)(135TRIAZIN2YL))(2METHOXYPHENYL)AMINE
(4Z)6(((5AMINO134THIADIAZOL2YL)SULFANYL)METHYL)4((2METHOXYPHENYL)IMINO)45DIHYDRO135TRIAZIN2AMINE
6(((5AMINO134THIADIAZOL2YL)SULFANYL)METHYL)N(2METHOXYPHENYL)135TRIAZINE24DIAMINE
6(((5amino134thiadiazol2yl)thio)methyl)N2(2methoxyphenyl)135triazine24diamine
6((5AMINO134THIADIAZOL2YL)SULFANYLMETHYL)2N(2METHOXYPHENYL)135TRIAZINE24DIAMINE
COC1=CC=CC=C1NC2=NC(=NC(=N2)N)CSC3=NN=C(S3)N
InChI=1SC13H14N8OS2c122853247(8)1612189(1710(14)1912)62313212011(15)2413h25H6H21H3(H21520)(H31416171819)
MFCD04186116
ZINC02419736
ZINC2419736

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Available files

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