Vitas-M small molecule compound
4-(morpholin-4-yl)-3-nitro-N-{2-[4-(propan-2-yl)phenyl]-2H-benzotriazol-5-yl}benzamide
Catalog ID
STK520163
SMILES O=C(c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1)Nc1ccc2c(c1)nn(n2)c1ccc(cc1)C(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 C26H26N6O4 MW 486.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N6O4/c1-17(2)18-3-7-21(8-4-18)31-28-22-9-6-20(16-23(22)29-31)27-26(33)19-5-10-24(25(15-19)32(34)35)30-11-13-36-14-12-30/h3-10,15-17H,11-14H2,1-2H3,(H,27,33)InChIKey
SGOKSUXZCZIPKJ-UHFFFAOYSA-NSynonyms
4(morpholin4yl)3nitroN(2(4(propan2yl)phenyl)2Hbenzotriazol5yl)benzamide
4morpholin4yl3nitroN(2(4propan2ylphenyl)benzotriazol5yl)benzamide
CC(C)C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=C(C=C4)N5CCOCC5)(N+)(=O)(O)
InChI=1SC26H26N6O4c117(2)183721(8418)3128229620(1623(22)2931)2726(33)1951024(25(1519)32(34)35)30111336141230h3101517H1114H212H3(H2733)
MFCD09453986
O=C(c1ccc(c(c1)(N+)(=O)(O))N1CCOCC1)Nc1ccc2c(c1)nn(n2)c1ccc(cc1)C(C)C
ZINC000020550434
ZINC20550434
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