Vitas-M small molecule compound
4-bromo-N-[(E)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(5-methoxy-1H-indol-3-yl)ethyl]amino}methylidene]benzamide
Catalog ID
STK217867
SMILES COc1ccc2c(c1)c(CCN/C(=N\C(=O)c1ccc(cc1)Br)/Nc1nc(C)cc(n1)C)c[nH]2
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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 C25H25BrN6O2 MW 521.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25BrN6O2/c1-15-12-16(2)30-25(29-15)32-24(31-23(33)17-4-6-19(26)7-5-17)27-11-10-18-14-28-22-9-8-20(34-3)13-21(18)22/h4-9,12-14,28H,10-11H2,1-3H3,(H2,27,29,30,31,32,33)InChIKey
FILPHRWALATHNA-UHFFFAOYSA-NSynonyms
(2E)3((46DIMETHYLPYRIMIDIN2YL)AMINO)1(4BROMOPHENYL)3((2(5METHOXYINDOL3YL)ETHYL)AMINO)2AZAPROP2EN1ONE
4bromoN((E)((46dimethylpyrimidin2yl)amino)((2(5methoxy1Hindol3yl)ethyl)amino)methylidene)benzamide
4bromoN(N(46dimethylpyrimidin2yl)N(2(5methoxy1Hindol3yl)ethyl)carbamimidoyl)benzamide
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)OC)NC(=O)C4=CC=C(C=C4)Br)C
COc1ccc2c(c1)c(CCNC(=NC(=O)c1ccc(cc1)Br)Nc1nc(C)cc(n1)C)c(nH)2
InChI=1SC25H25BrN6O2c1151216(2)3025(2915)3224(3123(33)174619(26)7517)271110181428229820(343)1321(18)22h49121428H1011H213H3(H2272930313233)
MFCD06755184
ZINC000014671520
ZINC14671520
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