Vitas-M small molecule compound
2-{[(2Z)-4,6-dimethylpyrimidin-2(1H)-ylidene]amino}-3-[2-(1H-indol-3-yl)ethyl]-6-oxo-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid
Catalog ID
STL535177
SMILES O=C1N=C(/N=c/2\nc(C)cc([nH]2)C)N(C(C1)C(=O)O)CCc1c[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 C21H22N6O3 MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O3/c1-12-9-13(2)24-20(23-12)26-21-25-18(28)10-17(19(29)30)27(21)8-7-14-11-22-16-6-4-3-5-15(14)16/h3-6,9,11,17,22H,7-8,10H2,1-2H3,(H,29,30)(H,23,24,25,26,28)InChIKey
HETGDFGOWMPMCK-UHFFFAOYSA-NSynonyms
1009694-60-3(2~(E))2(46dimethylpyrimidin2yl)imino3(2(1~(H)indol3yl)ethyl)6oxo13diazinane4carboxylicacid
1009694603
135435880
2(((2Z)46dimethylpyrimidin2(1H)ylidene)amino)3(2(1Hindol3yl)ethyl)6oxo3456tetrahydropyrimidine4carboxylicacid
2((46DIMETHYLPYRIMIDIN2YL)AMINO)3(2(1HINDOL3YL)ETHYL)6OXO45DIHYDROPYRIMIDINE4CARBOXYLICACID
2((46DIMETHYLPYRIMIDIN2YL)AMINO)3(2INDOL3YLETHYL)6OXO345TRIHYDROPYRIMIDINE4CARBOXYLICACID
InChI=1SC21H22N6O3c112913(2)2420(2312)26212518(28)1017(19(29)30)27(21)8714112216643515(14)16h369111722H7810H212H3(H2930)(H2324252628)
MFCD04074051
ZINC000001311570
ZINC000001311572
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