Vitas-M small molecule compound
2-phenoxyethyl 6-methyl-4-(2-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK402432
SMILES O=C1NC(=C(C(N1)c1ccccc1[N+](=O)[O-])C(=O)OCCOc1ccccc1)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 C20H19N3O6 MW 397.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N3O6/c1-13-17(19(24)29-12-11-28-14-7-3-2-4-8-14)18(22-20(25)21-13)15-9-5-6-10-16(15)23(26)27/h2-10,18H,11-12H2,1H3,(H2,21,22,25)InChIKey
ZWLGPSHMODGGRF-UHFFFAOYSA-NSynonyms
2PHENOXYETHYL4METHYL6(2NITROPHENYL)2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
2phenoxyethyl6methyl4(2nitrophenyl)2oxo1234tetrahydropyrimidine5carboxylate
2PHENOXYETHYL6METHYL4(2NITROPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CC1=C(C(NC(=O)N1)C2=CC=CC=C2(N+)(=O)(O))C(=O)OCCOC3=CC=CC=C3
InChI=1SC20H19N3O6c11317(19(24)29121128147324814)18(2220(25)2113)159561016(15)23(26)27h21018H1112H21H3(H2212225)
MFCD01192549
O=C1NC(=C(C(N1)c1ccccc1(N+)(=O)(O))C(=O)OCCOc1ccccc1)C
ZINC000005008670
ZINC000005008671
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