Vitas-M small molecule compound
2-{[5-(2,3-dihydro-1,4-benzodioxin-2-yl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-nitrophenyl)ethanone
Catalog ID
STK839626
SMILES O=C(c1cccc(c1)[N+](=O)[O-])CSc1nnc(n1c1ccccc1)C1COc2c(O1)cccc2
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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 C24H18N4O5S MW 474.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N4O5S/c29-19(16-7-6-10-18(13-16)28(30)31)15-34-24-26-25-23(27(24)17-8-2-1-3-9-17)22-14-32-20-11-4-5-12-21(20)33-22/h1-13,22H,14-15H2InChIKey
QFIBPWHAZFRDRM-UHFFFAOYSA-NSynonyms
326881-84-92((5(23dihydro14benzodioxin2yl)4phenyl4H124triazol3yl)sulfanyl)1(3nitrophenyl)ethanone
2((5(23DIHYDRO14BENZODIOXIN3YL)4PHENYL124TRIAZOL3YL)SULFANYL)1(3NITROPHENYL)ETHANONE
2((5(23DIHYDROBENZO(B)(14)DIOXIN2YL)4PHENYL4H124TRIAZOL3YL)THIO)1(3NITROPHENYL)ETHANONE
2(5(2H3HBENZO(E)14DIOXIN2YL)4PHENYL(124TRIAZOL3YLTHIO))1(3NITROPHENYL)ETHAN1ONE
326881849
C1C(OC2=CC=CC=C2O1)C3=NN=C(N3C4=CC=CC=C4)SCC(=O)C5=CC(=CC=C5)(N+)(=O)(O)
InChI=1SC24H18N4O5Sc2919(16761018(1316)28(30)31)153424262523(27(24)178213917)2214322011451221(20)3322h11322H1415H2
MFCD02658217
O=C(c1cccc(c1)(N+)(=O)(O))CSc1nnc(n1c1ccccc1)C1COc2c(O1)cccc2
ZINC000001170809
ZINC000001170810
Check stock
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Check stock on Vitas-MAvailable files
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