Vitas-M small molecule compound
diethyl (2Z)-5-amino-2-(3-nitrobenzylidene)-7-(3-nitrophenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
Catalog ID
STK790930
SMILES CCOC(=O)C1=c2s/c(=C\c3cccc(c3)[N+](=O)[O-])/c(=O)n2C(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OCC)N
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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 C26H22N4O9S MW 566.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O9S/c1-3-38-25(32)20-19(15-8-6-10-17(13-15)30(36)37)21(26(33)39-4-2)24-28(22(20)27)23(31)18(40-24)12-14-7-5-9-16(11-14)29(34)35/h5-13,19H,3-4,27H2,1-2H3/b18-12-InChIKey
NEMROETYZCNIPI-PDGQHHTCSA-NSynonyms
(Z)diethyl5amino2(3nitrobenzylidene)7(3nitrophenyl)3oxo37dihydro2Hthiazolo(32a)pyridine68dicarboxylate
CCOC(=O)C1=C(N2C(=C(C1C3=CC(=CC=C3)(N+)(=O)(O))C(=O)OCC)SC(=CC4=CC(=CC=C4)(N+)(=O)(O))C2=O)N
CCOC(=O)C1=c2sc(=Cc3cccc(c3)(N+)(=O)(O))c(=O)n2C(=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)OCC)N
diethyl(2Z)5amino2(3nitrobenzylidene)7(3nitrophenyl)3oxo23dihydro7H(13)thiazolo(32a)pyridine68dicarboxylate
DIETHYL(2Z)5AMINO7(3NITROPHENYL)2((3NITROPHENYL)METHYLIDENE)3OXO7H(13)THIAZOLO(32A)PYRIDINE68DICARBOXYLATE
InChI=1SC26H22N4O9Sc133825(32)2019(15861017(1315)30(36)37)21(26(33)3942)2428(22(20)27)23(31)18(4024)121475916(1114)29(34)35h51319H3427H212H3b1812
MFCD01557240
ZINC000001864866
ZINC000001864869
Check stock
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Check stock on Vitas-MAvailable files
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