Vitas-M small molecule compound
1-(3,4-dimethylphenyl)-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Catalog ID
STK927251
SMILES Cc1nnc([nH]1)SCC(=O)c1ccc(c(c1)C)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 C13H15N3OS MW 261.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3OS/c1-8-4-5-11(6-9(8)2)12(17)7-18-13-14-10(3)15-16-13/h4-6H,7H2,1-3H3,(H,14,15,16)InChIKey
KDAMDJSWTHTSHE-UHFFFAOYSA-NSynonyms
1(34DIMETHYLPHENYL)2((5METHYL1H124TRIAZOL3YL)SULFANYL)ETHANONE
1(34DIMETHYLPHENYL)2((5METHYL4H124TRIAZOL3YL)SULFANYL)ETHAN1ONE
1(34dimethylphenyl)2((5methyl4H124triazol3yl)sulfanyl)ethanone
CC1=C(C=C(C=C1)C(=O)CSC2=NNC(=N2)C)C
Cc1nnc((nH)1)SCC(=O)c1ccc(c(c1)C)C
InChI=1SC13H15N3OSc184511(69(8)2)12(17)718131410(3)151613h46H7H213H3(H141516)
MFCD02366270
ZINC000000285696
ZINC00285696
ZINC285696
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