Vitas-M small molecule compound
4-(cyclohex-3-en-1-yl)-2-[(4-methoxybenzyl)amino]-8-methyl-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one
Catalog ID
STK260206
SMILES COc1ccc(cc1)CNC1=NC(C2CCC=CC2)n2c(N1)nc(cc2=O)C
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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 C21H25N5O2 MW 379.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O2/c1-14-12-18(27)26-19(16-6-4-3-5-7-16)24-20(25-21(26)23-14)22-13-15-8-10-17(28-2)11-9-15/h3-4,8-12,16,19H,5-7,13H2,1-2H3,(H2,22,23,24,25)InChIKey
IVIIJBQRVGWIQK-UHFFFAOYSA-NSynonyms
4(cyclohex3en1yl)2((4methoxybenzyl)amino)8methyl14dihydro6Hpyrimido(12a)(135)triazin6one
4(CYCLOHEX3ENYL)2(4METHOXYBENZYLAMINO)8METHYL1HPYRIMIDO(12A)(135)TRIAZIN6(4H)ONE
4cyclohex3en1yl2((4methoxyphenyl)methylamino)8methyl49dihydropyrimido(12a)(135)triazin6one
4CYCLOHEX3ENYL2(((4METHOXYPHENYL)METHYL)AMINO)8METHYL5HYDRO1H4HPYRIMIDINO(21B)135TRIAZIN6ONE
CC1=CC(=O)N2C(N=C(N=C2N1)NCC3=CC=C(C=C3)OC)C4CCC=CC4
InChI=1SC21H25N5O2c1141218(27)2619(166435716)2420(2521(26)2314)22131581017(282)11915h348121619H5713H212H3(H222232425)
MFCD08132021
ZINC000009426312
ZINC000009426314
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