Vitas-M small molecule compound

1-[(E)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(1H-imidazol-4-yl)ethyl]amino}methylidene]-3-phenylurea

Catalog ID
STK207421
SMILES O=C(/N=C(/Nc1nc(C)cc(n1)C)\NCCc1c[nH]cn1)Nc1ccccc1

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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 C19H22N8O MW 378.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N8O/c1-13-10-14(2)24-18(23-13)26-17(21-9-8-16-11-20-12-22-16)27-19(28)25-15-6-4-3-5-7-15/h3-7,10-12H,8-9H2,1-2H3,(H,20,22)(H3,21,23,24,25,26,27,28)
InChIKey
DFSFQNQMKZOAMJ-UHFFFAOYSA-N
Synonyms

(2E)3((46DIMETHYLPYRIMIDIN2YL)AMINO)3((2IMIDAZOL4YLETHYL)AMINO)NPHENYL2AZAPROP2ENAMIDE
1((E)((46dimethylpyrimidin2yl)amino)((2(1Himidazol4yl)ethyl)amino)methylidene)3phenylurea
1(N(46DIMETHYLPYRIMIDIN2YL)N(2(1HIMIDAZOL5YL)ETHYL)CARBAMIMIDOYL)3PHENYLUREA
CC1=CC(=NC(=N1)NC(=NCCC2=CN=CN2)NC(=O)NC3=CC=CC=C3)C
InChI=1SC19H22N8Oc1131014(2)2418(2313)2617(2198161120122216)2719(28)25156435715h371012H89H212H3(H2022)(H321232425262728)
MFCD06754494
N((1E)((46DIMETHYLPYRIMIDIN2YL)AMINO)((2(1HIMIDAZOL4YL)ETHYL)AMINO)METHYLENE)NPHENYLUREA
O=C(N=C(Nc1nc(C)cc(n1)C)NCCc1c(nH)cn1)Nc1ccccc1
ZINC000014729857
ZINC14729857

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Available files

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