Vitas-M small molecule compound
1-(1-benzofuran-2-yl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)ethanone
Catalog ID
STK522304
SMILES O=C(c1cc2c(o1)cccc2)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 C12H9N3O2S MW 259.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9N3O2S/c16-9(6-18-12-13-7-14-15-12)11-5-8-3-1-2-4-10(8)17-11/h1-5,7H,6H2,(H,13,14,15)InChIKey
GROGFVOVCPFNAP-UHFFFAOYSA-NSynonyms
851103-19-01(1BENZOFURAN2YL)2(1H124TRIAZOL5YLSULFANYL)ETHANONE
1(1benzofuran2yl)2(4H124triazol3ylsulfanyl)ethanone
851103190
C1=CC=C2C(=C1)C=C(O2)C(=O)CSC3=NC=NN3
InChI=1SC12H9N3O2Sc169(61812137141512)1158312410(8)1711h157H6H2(H131415)
MFCD03658420
O=C(c1cc2c(o1)cccc2)CSc1nnc(nH)1
ZINC000017972412
ZINC17972412
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