Vitas-M small molecule compound
4-tert-butyl-N-{N'-(4,6-dimethylpyrimidin-2-yl)-N-[2-(1H-indol-3-yl)ethyl]carbamimidoyl}benzamide
Catalog ID
STK210592
SMILES Cc1cc(C)nc(n1)/N=C(/NC(=O)c1ccc(cc1)C(C)(C)C)\NCCc1c[nH]c2c1cccc2
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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 C28H32N6O MW 468.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N6O/c1-18-16-19(2)32-27(31-18)34-26(29-15-14-21-17-30-24-9-7-6-8-23(21)24)33-25(35)20-10-12-22(13-11-20)28(3,4)5/h6-13,16-17,30H,14-15H2,1-5H3,(H2,29,31,32,33,34,35)InChIKey
DTCTTZBPIWZIOC-UHFFFAOYSA-NSynonyms
774560-22-4(2Z)1(4(TERTBUTYL)PHENYL)3((46DIMETHYLPYRIMIDIN2YL)AMINO)3((2INDOL3YLETHYL)AMINO)2AZAPROP2EN1ONE
(E)N(N(2(1Hindol3yl)ethyl)N(46dimethylpyrimidin2yl)carbamimidoyl)4(tertbutyl)benzamide
4TERTBUTYLN((Z)((46DIMETHYLPYRIMIDIN2YL)AMINO)((2(1HINDOL3YL)ETHYL)AMINO)METHYLIDENE)BENZAMIDE
4TERTBUTYLN(N(46DIMETHYLPYRIMIDIN2YL)N(2(1HINDOL3YL)ETHYL)CARBAMIMIDOYL)BENZAMIDE
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=CC=CC=C32)NC(=O)C4=CC=C(C=C4)C(C)(C)C)C
Cc1cc(C)nc(n1)N=C(NC(=O)c1ccc(cc1)C(C)(C)C)NCCc1c(nH)c2c1cccc2
InChI=1SC28H32N6Oc1181619(2)3227(3118)3426(29151421173024976823(21)24)3325(35)20101222(131120)28(34)5h613161730H1415H215H3(H2293132333435)
MFCD06613729
ZINC18081761
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.