Vitas-M small molecule compound
2-(morpholin-4-yl)-5-nitro-N-{2-[4-(propan-2-yl)phenyl]-2H-benzotriazol-5-yl}benzamide
Catalog ID
STK520164
SMILES O=C(c1cc(ccc1N1CCOCC1)[N+](=O)[O-])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)18-3-6-20(7-4-18)31-28-23-9-5-19(15-24(23)29-31)27-26(33)22-16-21(32(34)35)8-10-25(22)30-11-13-36-14-12-30/h3-10,15-17H,11-14H2,1-2H3,(H,27,33)InChIKey
UPTUHNWOBYOXAE-UHFFFAOYSA-NSynonyms
2(morpholin4yl)5nitroN(2(4(propan2yl)phenyl)2Hbenzotriazol5yl)benzamide
2morpholin4yl5nitroN(2(4propan2ylphenyl)benzotriazol5yl)benzamide
CC(C)C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C=CC(=C4)(N+)(=O)(O))N5CCOCC5
InChI=1SC26H26N6O4c117(2)183620(7418)3128239519(1524(23)2931)2726(33)221621(32(34)35)81025(22)30111336141230h3101517H1114H212H3(H2733)
MFCD09453988
O=C(c1cc(ccc1N1CCOCC1)(N+)(=O)(O))Nc1ccc2c(c1)nn(n2)c1ccc(cc1)C(C)C
ZINC000020550432
ZINC20550432
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