Vitas-M small molecule compound
1-{[5-(furan-2-yl)-4-(furan-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-3,3-dimethylbutan-2-one
Catalog ID
STL341466
SMILES O=C(C(C)(C)C)CSc1nnc(n1Cc1ccco1)c1ccco1
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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 C17H19N3O3S MW 345.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O3S/c1-17(2,3)14(21)11-24-16-19-18-15(13-7-5-9-23-13)20(16)10-12-6-4-8-22-12/h4-9H,10-11H2,1-3H3InChIKey
HLKDPUUCGZANMK-UHFFFAOYSA-NSynonyms
577696-77-61((5(FURAN2YL)4(FURAN2YLMETHYL)124TRIAZOL3YL)SULFANYL)33DIMETHYLBUTAN2ONE
1((5(furan2yl)4(furan2ylmethyl)4H124triazol3yl)sulfanyl)33dimethylbutan2one
1((5(furan2yl)4(furan2ylmethyl)4H124triazol3yl)thio)33dimethylbutan2one
1(5(2FURYL)4(2FURYLMETHYL)(124TRIAZOL3YLTHIO))33DIMETHYLBUTAN2ONE
577696776
CC(C)(C)C(=O)CSC1=NN=C(N1CC2=CC=CO2)C3=CC=CO3
InChI=1SC17H19N3O3Sc117(23)14(21)112416191815(137592313)20(16)10126482212h49H1011H213H3
MFCD04027670
ZINC000000531844
ZINC00531844
ZINC531844
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