Vitas-M small molecule compound

1-(4-methoxyphenyl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)ethanone

Catalog ID
STK506971
SMILES COc1ccc(cc1)C(=O)CSc1nnc[nH]1

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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 C11H11N3O2S MW 249.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11N3O2S/c1-16-9-4-2-8(3-5-9)10(15)6-17-11-12-7-13-14-11/h2-5,7H,6H2,1H3,(H,12,13,14)
InChIKey
UAGDMDMGLFBFPG-UHFFFAOYSA-N
Synonyms
332169-82-1
1(4METHOXYPHENYL)2(1H124TRIAZOL5YLSULFANYL)ETHAN1ONE
1(4METHOXYPHENYL)2(1H124TRIAZOL5YLSULFANYL)ETHANONE
1(4METHOXYPHENYL)2(4H(124)TRIAZOL3YLSULFANYL)ETHANONE
1(4methoxyphenyl)2(4H124triazol3ylsulfanyl)ethanone
2((4H124TRIAZOL3YL)THIO)1(4METHOXYPHENYL)ETHANONE
2(4H124TRIAZOL3YLTHIO)1(4METHOXYPHENYL)ETHAN1ONE
332169821
COC1=CC=C(C=C1)C(=O)CSC2=NC=NN2
COc1ccc(cc1)C(=O)CSc1nnc(nH)1
InChI=1SC11H11N3O2Sc1169428(359)10(15)61711127131411h257H6H21H3(H121314)
MFCD02045307
ZINC000005729784
ZINC05729784
ZINC5729784

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Available files

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