Vitas-M small molecule compound

3-(propylsulfanyl)-N-[(E)-thiophen-2-ylmethylidene]-7H-[1,2,4]triazolo[4,3-b][1,2,4]triazol-7-amine

Catalog ID
STK755843
SMILES CCCSc1nnc2n1ncn2/N=C/c1cccs1

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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 C11H12N6S2 MW 292.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12N6S2/c1-2-5-19-11-15-14-10-16(8-13-17(10)11)12-7-9-4-3-6-18-9/h3-4,6-8H,2,5H2,1H3/b12-7+
InChIKey
RDTGKJNXASRKDO-KPKJPENVSA-N
Synonyms

(E)N(3propylsulfanyl(124)triazolo(43b)(124)triazol7yl)1thiophen2ylmethanimine
3(propylsulfanyl)N((E)thiophen2ylmethylidene)7H(124)triazolo(43b)(124)triazol7amine
CCCSC1=NN=C2N1N=CN2N=CC3=CC=CS3
CCCSc1nnc2n1ncn2N=Cc1cccs1
InChI=1SC11H12N6S2c125191115141016(81317(10)11)1279436189h3468H25H21H3b127+
MFCD01113779
ZINC000003663456
ZINC33760641

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Available files

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