Vitas-M small molecule compound
cyclohexyl 1-ethyl-6-methyl-4-(2-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK363470
SMILES CCN1C(=O)NC(C(=C1C)C(=O)OC1CCCCC1)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 C20H25N3O5 MW 387.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O5/c1-3-22-13(2)17(19(24)28-14-9-5-4-6-10-14)18(21-20(22)25)15-11-7-8-12-16(15)23(26)27/h7-8,11-12,14,18H,3-6,9-10H2,1-2H3,(H,21,25)InChIKey
QYXSPGQVDSUOPQ-UHFFFAOYSA-NSynonyms
5757-62-05757620
CCN1C(=C(C(NC1=O)C2=CC=CC=C2(N+)(=O)(O))C(=O)OC3CCCCC3)C
CCN1C(=O)NC(C(=C1C)C(=O)OC1CCCCC1)c1ccccc1(N+)(=O)(O)
cyclohexyl1ethyl6methyl4(2nitrophenyl)2oxo1234tetrahydropyrimidine5carboxylate
CYCLOHEXYL3ETHYL4METHYL6(2NITROPHENYL)2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
CYCLOHEXYL3ETHYL4METHYL6(2NITROPHENYL)2OXO16DIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC20H25N3O5c132213(2)17(19(24)281495461014)18(2120(22)25)1511781216(15)23(26)27h7811121418H36910H212H3(H2125)
MFCD01193820
ZINC000000844344
ZINC000000844345
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