Vitas-M small molecule compound
1-(4-{[5-(furan-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-3-nitrophenyl)ethanone
Catalog ID
STL356670
SMILES [O-][N+](=O)c1cc(ccc1Sc1nnc(n1c1ccccc1)c1ccco1)C(=O)C
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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 C20H14N4O4S MW 406.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N4O4S/c1-13(25)14-9-10-18(16(12-14)24(26)27)29-20-22-21-19(17-8-5-11-28-17)23(20)15-6-3-2-4-7-15/h2-12H,1H3InChIKey
FHCXYQLHVDFHMS-UHFFFAOYSA-NSynonyms
311793-78-9(O)(N+)(=O)c1cc(ccc1Sc1nnc(n1c1ccccc1)c1ccco1)C(=O)C
1(4((5(FURAN2YL)4PHENYL124TRIAZOL3YL)SULFANYL)3NITROPHENYL)ETHANONE
1(4((5(furan2yl)4phenyl4H124triazol3yl)sulfanyl)3nitrophenyl)ethanone
1(4((5(furan2yl)4phenyl4H124triazol3yl)thio)3nitrophenyl)ethanone
311793789
CC(=O)C1=CC(=C(C=C1)SC2=NN=C(N2C3=CC=CC=C3)C4=CC=CO4)(N+)(=O)(O)
InChI=1SC20H14N4O4Sc113(25)1491018(16(1214)24(26)27)2920222119(1785112817)23(20)156324715h212H1H3
MFCD01204538
ZINC000000867248
ZINC00867248
ZINC867248
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