Vitas-M small molecule compound
N-(4-iodophenyl)-6-{(2E)-2-[4-(morpholin-4-yl)-3-nitrobenzylidene]hydrazinyl}[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine
Catalog ID
STK674309
SMILES Ic1ccc(cc1)Nc1nc2nonc2nc1N/N=C/c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1
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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 C21H18IN9O4 MW 587.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18IN9O4/c22-14-2-4-15(5-3-14)24-18-19(26-21-20(25-18)28-35-29-21)27-23-12-13-1-6-16(17(11-13)31(32)33)30-7-9-34-10-8-30/h1-6,11-12H,7-10H2,(H,24,25,28)(H,26,27,29)/b23-12+InChIKey
BWGNHDWBVDIABW-FSJBWODESA-NSynonyms
6N(4iodophenyl)5N((E)(4morpholin4yl3nitrophenyl)methylideneamino)(125)oxadiazolo(34b)pyrazine56diamine
C1COCCN1C2=C(C=C(C=C2)C=NNC3=NC4=NON=C4N=C3NC5=CC=C(C=C5)I)(N+)(=O)(O)
Ic1ccc(cc1)Nc1nc2nonc2nc1NN=Cc1ccc(c(c1)(N+)(=O)(O))N1CCOCC1
InChI=1SC21H18IN9O4c22142415(5314)241819(262120(2518)28352921)272312131616(17(1113)31(32)33)30793410830h161112H710H2(H242528)(H262729)b2312+
MFCD01305286
N(4iodophenyl)6((2E)2(4(morpholin4yl)3nitrobenzylidene)hydrazinyl)(125)oxadiazolo(34b)pyrazin5amine
ZINC000006444949
ZINC102779068
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