Vitas-M small molecule compound
(2Z)-6,7-dimethyl-2-[4-(morpholin-4-yl)-3-nitrobenzylidene][1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK759853
SMILES [O-][N+](=O)c1cc(ccc1N1CCOCC1)/C=c/1\sc2n(c1=O)c1c(n2)cc(c(c1)C)C
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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 C22H20N4O4S MW 436.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O4S/c1-13-9-16-18(10-14(13)2)25-21(27)20(31-22(25)23-16)12-15-3-4-17(19(11-15)26(28)29)24-5-7-30-8-6-24/h3-4,9-12H,5-8H2,1-2H3/b20-12-InChIKey
UKIPFYPKRYEHNS-NDENLUEZSA-NSynonyms
(2Z)67DIMETHYL2((4MORPHOLIN4YL3NITROPHENYL)METHYLIDENE)(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
(2Z)67dimethyl2(4(morpholin4yl)3nitrobenzylidene)(13)thiazolo(32a)benzimidazol3(2H)one
(O)(N+)(=O)c1cc(ccc1N1CCOCC1)C=c1sc2n(c1=O)c1c(n2)cc(c(c1)C)C
2(3NITRO4(4MORPHOLINYL)BENZYLIDENE)67DIMETHYL(13)THIAZOLO(32A)BENZIMIDAZOL3(2H)ONE
CC1=CC2=C(C=C1C)N3C(=O)C(=CC4=CC(=C(C=C4)N5CCOCC5)(N+)(=O)(O))SC3=N2
InChI=1SC22H20N4O4Sc11391618(1014(13)2)2521(27)20(3122(25)2316)12153417(19(1115)26(28)29)2457308624h34912H58H212H3b2012
MFCD01160769
ZINC000008443381
ZINC08443381
ZINC8443381
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