Vitas-M small molecule compound

5-cyclopropyl-4-(2,4-dimethylphenyl)-4H-1,2,4-triazole-3-thiol

Catalog ID
STK019301
SMILES Cc1ccc(c(c1)C)n1c(S)nnc1C1CC1

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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 C13H15N3S MW 245.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3S/c1-8-3-6-11(9(2)7-8)16-12(10-4-5-10)14-15-13(16)17/h3,6-7,10H,4-5H2,1-2H3,(H,15,17)
InChIKey
JGAPHJWUAOUHNU-UHFFFAOYSA-N
Synonyms

3CYCLOPROPYL4(24DIMETHYLPHENYL)1H124TRIAZOLE5THIONE
5CYCLOPROPYL4(24DIMETHYLPHENYL)4H124TRIAZOL3YLHYDROSULFIDE
5CYCLOPROPYL4(24DIMETHYLPHENYL)4H124TRIAZOLE3THIOL
CC1=CC(=C(C=C1)N2C(=NNC2=S)C3CC3)C
Cc1ccc(c(c1)C)n1c(S)nnc1C1CC1
InChI=1SC13H15N3Sc183611(9(2)78)1612(104510)141513(16)17h36710H45H212H3(H1517)
MFCD03488768
STK019301
ZINC000005687720
ZINC05687720
ZINC5687720

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Available files

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