Vitas-M small molecule compound
2-phenylethyl 1,6-dimethyl-4-(2-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK025840
SMILES O=C1NC(C(=C(N1C)C)C(=O)OCCc1ccccc1)c1ccccc1[N+](=O)[O-]
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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 C21H21N3O5 MW 395.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O5/c1-14-18(20(25)29-13-12-15-8-4-3-5-9-15)19(22-21(26)23(14)2)16-10-6-7-11-17(16)24(27)28/h3-11,19H,12-13H2,1-2H3,(H,22,26)InChIKey
GQJFYGMCBNLWTN-UHFFFAOYSA-NSynonyms
2phenylethyl16dimethyl4(2nitrophenyl)2oxo1234tetrahydropyrimidine5carboxylate
2PHENYLETHYL34DIMETHYL6(2NITROPHENYL)2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
2phenylethyl34dimethyl6(2nitrophenyl)2oxo16dihydropyrimidine5carboxylate
CC1=C(C(NC(=O)N1C)C2=CC=CC=C2(N+)(=O)(O))C(=O)OCCC3=CC=CC=C3
InChI=1SC21H21N3O5c11418(20(25)291312158435915)19(2221(26)23(14)2)1610671117(16)24(27)28h31119H1213H212H3(H2226)
MFCD01193786
O=C1NC(C(=C(N1C)C)C(=O)OCCc1ccccc1)c1ccccc1(N+)(=O)(O)
PHENETHYL34DIMETHYL6(2NITROPHENYL)2OXO16DIHYDROPYRIMIDINE5CARBOXYLATE
STK025840
ZINC000001080972
ZINC000001080973
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