Vitas-M small molecule compound
2-{4-(furan-2-ylmethyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyrazine
Catalog ID
STL052471
SMILES [O-][N+](=O)c1ccc(cc1)CSc1nnc(n1Cc1ccco1)c1cnccn1
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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 C18H14N6O3S MW 394.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N6O3S/c25-24(26)14-5-3-13(4-6-14)12-28-18-22-21-17(16-10-19-7-8-20-16)23(18)11-15-2-1-9-27-15/h1-10H,11-12H2InChIKey
JIPOZOMPNJLJOG-UHFFFAOYSA-NSynonyms
676641-07-9(O)(N+)(=O)c1ccc(cc1)CSc1nnc(n1Cc1ccco1)c1cnccn1
2(4(FURAN2YLMETHYL)5(((4NITROPHENYL)METHYL)SULFANYL)4H124TRIAZOL3YL)PYRAZINE
2(4(furan2ylmethyl)5((4nitrobenzyl)sulfanyl)4H124triazol3yl)pyrazine
2(4(furan2ylmethyl)5((4nitrobenzyl)thio)4H124triazol3yl)pyrazine
2(4(FURAN2YLMETHYL)5((4NITROPHENYL)METHYLSULFANYL)124TRIAZOL3YL)PYRAZINE
4(2FURYLMETHYL)3((4NITROPHENYL)METHYLTHIO)5PYRAZIN2YL124TRIAZOLE
676641079
C1=COC(=C1)CN2C(=NN=C2SCC3=CC=C(C=C3)(N+)(=O)(O))C4=NC=CN=C4
InChI=1SC18H14N6O3Sc2524(26)145313(4614)122818222117(161019782016)23(18)11152192715h110H1112H2
MFCD04009832
ZINC000001057952
ZINC01057952
ZINC1057952
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