Vitas-M small molecule compound
3-(3-fluorophenyl)-5-[(3-nitrobenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole
Catalog ID
STK126399
SMILES Fc1cccc(c1)c1nnc(n1c1ccccc1)SCc1cccc(c1)[N+](=O)[O-]
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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 C21H15FN4O2S MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15FN4O2S/c22-17-8-5-7-16(13-17)20-23-24-21(25(20)18-9-2-1-3-10-18)29-14-15-6-4-11-19(12-15)26(27)28/h1-13H,14H2InChIKey
WSYLDKGMLDVWMJ-UHFFFAOYSA-NSynonyms
442630-22-03(3FLUOROPHENYL)5((3NITROBENZYL)SULFANYL)4PHENYL4H124TRIAZOLE
3(3fluorophenyl)5((3nitrobenzyl)thio)4phenyl4H124triazole
3(3FLUOROPHENYL)5((3NITROPHENYL)METHYLSULFANYL)4PHENYL124TRIAZOLE
442630220
5(3FLUOROPHENYL)3((3NITROPHENYL)METHYLTHIO)4PHENYL124TRIAZOLE
C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)(N+)(=O)(O))C4=CC(=CC=C4)F
Fc1cccc(c1)c1nnc(n1c1ccccc1)SCc1cccc(c1)(N+)(=O)(O)
InChI=1SC21H15FN4O2Sc221785716(1317)20232421(25(20)1892131018)291415641119(1215)26(27)28h113H14H2
MFCD01230305
ZINC000001102603
ZINC01102603
ZINC1102603
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