Vitas-M small molecule compound

3,3'-[(2,5-dimethylbenzene-1,4-diyl)bis(methanediylsulfanediyl)]bis(4H-1,2,4-triazole)

Catalog ID
STK037424
SMILES Cc1cc(CSc2[nH]cnn2)c(cc1CSc1[nH]cnn1)C

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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 C14H16N6S2 MW 332.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N6S2/c1-9-3-12(6-22-14-16-8-18-20-14)10(2)4-11(9)5-21-13-15-7-17-19-13/h3-4,7-8H,5-6H2,1-2H3,(H,15,17,19)(H,16,18,20)
InChIKey
MUGPEJVPHDJUAF-UHFFFAOYSA-N
Synonyms
309281-44-5
309281445
33(((25dimethyl14phenylene)bis(methylene))bis(sulfanediyl))bis(4H124triazole)
33((25DIMETHYLBENZENE14DIYL)BIS(METHANEDIYLSULFANEDIYL))BIS(4H124TRIAZOLE)
5((25DIMETHYL4(1H124TRIAZOL5YLSULFANYLMETHYL)PHENYL)METHYLSULFANYL)1H124TRIAZOLE
CC1=CC(=C(C=C1CSC2=NC=NN2)C)CSC3=NC=NN3
Cc1cc(CSc2(nH)cnn2)c(cc1CSc1(nH)cnn1)C
InChI=1SC14H16N6S2c19312(62214168182014)10(2)411(9)52113157171913h3478H56H212H3(H151719)(H161820)
MFCD01820514
STK037424
ZINC000018323667
ZINC18323667

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Available files

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