Vitas-M small molecule compound
2-{[5-(furan-2-yl)-4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-nitrophenyl)ethanone
Catalog ID
STK297353
SMILES O=C(c1cccc(c1)[N+](=O)[O-])CSc1nnc(n1C(C)C)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 C17H16N4O4S MW 372.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N4O4S/c1-11(2)20-16(15-7-4-8-25-15)18-19-17(20)26-10-14(22)12-5-3-6-13(9-12)21(23)24/h3-9,11H,10H2,1-2H3InChIKey
ZUHCSTKYKJEPSY-UHFFFAOYSA-NSynonyms
2((5(furan2yl)4(propan2yl)4H124triazol3yl)sulfanyl)1(3nitrophenyl)ethanone
2((5(furan2yl)4propan2yl124triazol3yl)sulfanyl)1(3nitrophenyl)ethanone
2(5FURAN2YL4ISOPROPYL4H(124)TRIAZOL3YLSULFANYL)1(3NITROPHENYL)ETHANONE
CC(C)N1C(=NN=C1SCC(=O)C2=CC(=CC=C2)(N+)(=O)(O))C3=CC=CO3
InChI=1SC17H16N4O4Sc111(2)2016(157482515)181917(20)261014(22)1253613(912)21(23)24h3911H10H212H3
MFCD09960934
O=C(c1cccc(c1)(N+)(=O)(O))CSc1nnc(n1C(C)C)c1ccco1
ZINC000013956312
ZINC13956312
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