Vitas-M small molecule compound
2-cyanoethyl 6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK363507
SMILES COc1cc(cc(c1OC)OC)C1NC(=O)NC(=C1C(=O)OCCC#N)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 C18H21N3O6 MW 375.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O6/c1-10-14(17(22)27-7-5-6-19)15(21-18(23)20-10)11-8-12(24-2)16(26-4)13(9-11)25-3/h8-9,15H,5,7H2,1-4H3,(H2,20,21,23)InChIKey
JWFAVROYPZRFRT-UHFFFAOYSA-NSynonyms
2CYANOETHYL4METHYL2OXO6(345TRIMETHOXYPHENYL)136TRIHYDROPYRIMIDINE5CARBOXYLATE
2cyanoethyl6methyl2oxo4(345trimethoxyphenyl)1234tetrahydropyrimidine5carboxylate
2CYANOETHYL6METHYL2OXO4(345TRIMETHOXYPHENYL)34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CC1=C(C(NC(=O)N1)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)OCCC#N
InChI=1SC18H21N3O6c11014(17(22)2775619)15(2118(23)2010)11812(242)16(264)13(911)253h8915H57H214H3(H2202123)
MFCD01192367
ZINC000004113526
ZINC000004113527
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