Vitas-M small molecule compound
2-{[5-(furan-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-nitrophenyl)ethanone
Catalog ID
STK186998
SMILES O=C(c1cccc(c1)[N+](=O)[O-])CSc1nnc(n1C)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 C15H12N4O4S MW 344.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H12N4O4S/c1-18-14(13-6-3-7-23-13)16-17-15(18)24-9-12(20)10-4-2-5-11(8-10)19(21)22/h2-8H,9H2,1H3InChIKey
ADUHKDZEKNBUMU-UHFFFAOYSA-NSynonyms
2((5(2FURYL)4METHYL4H124TRIAZOL3YL)SULFANYL)1(3NITROPHENYL)1ETHANONE
2((5(FURAN2YL)4METHYL124TRIAZOL3YL)SULFANYL)1(3NITROPHENYL)ETHANONE
2((5(FURAN2YL)4METHYL4H124TRIAZOL3YL)SULFANYL)1(3NITROPHENYL)ETHANONE
CN1C(=NN=C1SCC(=O)C2=CC(=CC=C2)(N+)(=O)(O))C3=CC=CO3
InChI=1SC15H12N4O4Sc11814(136372313)161715(18)24912(20)1042511(810)19(21)22h28H9H21H3
MFCD02680613
O=C(c1cccc(c1)(N+)(=O)(O))CSc1nnc(n1C)c1ccco1
ZINC000000146578
ZINC00146578
ZINC146578
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