Vitas-M small molecule compound
1-[(E)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(1H-indol-3-yl)ethyl]amino}methylidene]-3-(4-nitrophenyl)urea
Catalog ID
STK203719
SMILES O=C(/N=C(/Nc1nc(C)cc(n1)C)\NCCc1c[nH]c2c1cccc2)Nc1ccc(cc1)[N+](=O)[O-]
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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 C24H24N8O3 MW 472.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N8O3/c1-15-13-16(2)28-23(27-15)30-22(25-12-11-17-14-26-21-6-4-3-5-20(17)21)31-24(33)29-18-7-9-19(10-8-18)32(34)35/h3-10,13-14,26H,11-12H2,1-2H3,(H3,25,27,28,29,30,31,33)InChIKey
BMEOGNYYLVWAEE-UHFFFAOYSA-NSynonyms
(2E)3((46DIMETHYLPYRIMIDIN2YL)AMINO)3((2INDOL3YLETHYL)AMINO)N(4NITROPHENYL)2AZAPROP2ENAMIDE
(E)1((2(1HINDOL3YL)ETHYLAMINO)(46DIMETHYLPYRIMIDIN2YLAMINO)METHYLENE)3(4NITROPHENYL)UREA
1((E)((46dimethylpyrimidin2yl)amino)((2(1Hindol3yl)ethyl)amino)methylidene)3(4nitrophenyl)urea
1(N(46DIMETHYLPYRIMIDIN2YL)N(2(1HINDOL3YL)ETHYL)CARBAMIMIDOYL)3(4NITROPHENYL)UREA
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=CC=CC=C32)NC(=O)NC4=CC=C(C=C4)(N+)(=O)(O))C
InChI=1SC24H24N8O3c1151316(2)2823(2715)3022(25121117142621643520(17)21)3124(33)29187919(10818)32(34)35h310131426H1112H212H3(H325272829303133)
MFCD06650305
O=C(N=C(Nc1nc(C)cc(n1)C)NCCc1c(nH)c2c1cccc2)Nc1ccc(cc1)(N+)(=O)(O)
ZINC000008770981
ZINC08770981
ZINC8770981
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.