Vitas-M small molecule compound
2-[(5-amino-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(3,4-dimethoxyphenyl)ethanone
Catalog ID
STK514295
SMILES COc1cc(ccc1OC)C(=O)CSc1nnc([nH]1)N
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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 C12H14N4O3S MW 294.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N4O3S/c1-18-9-4-3-7(5-10(9)19-2)8(17)6-20-12-14-11(13)15-16-12/h3-5H,6H2,1-2H3,(H3,13,14,15,16)InChIKey
UQWAUSUFLQSNHJ-UHFFFAOYSA-NSynonyms
757225-11-92((5AMINO1H124TRIAZOL3YL)SULFANYL)1(34DIMETHOXYPHENYL)ETHANONE
2((5amino4H124triazol3yl)sulfanyl)1(34dimethoxyphenyl)ethanone
2((5amino4H124triazol3yl)thio)1(34dimethoxyphenyl)ethanone
757225119
COC1=C(C=C(C=C1)C(=O)CSC2=NNC(=N2)N)OC
COc1cc(ccc1OC)C(=O)CSc1nnc((nH)1)N
InChI=1SC12H14N4O3Sc1189437(510(9)192)8(17)620121411(13)151612h35H6H212H3(H313141516)
MFCD04731583
ZINC000005959943
ZINC05959943
ZINC5959943
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