Vitas-M small molecule compound
cycloheptyl 4-(4-hydroxy-3-nitrophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK364162
SMILES O=C1NC(=C(C(N1)c1ccc(c(c1)[N+](=O)[O-])O)C(=O)OC1CCCCCC1)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 C19H23N3O6 MW 389.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O6/c1-11-16(18(24)28-13-6-4-2-3-5-7-13)17(21-19(25)20-11)12-8-9-15(23)14(10-12)22(26)27/h8-10,13,17,23H,2-7H2,1H3,(H2,20,21,25)InChIKey
FWIFDFYRAIFWKK-UHFFFAOYSA-NSynonyms
296267-13-5296267135
CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)O)(N+)(=O)(O))C(=O)OC3CCCCCC3
cycloheptyl4(4hydroxy3nitrophenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
CYCLOHEPTYL4(4HYDROXY3NITROPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CYCLOHEPTYL6(4HYDROXY3NITROPHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC19H23N3O6c11116(18(24)281364235713)17(2119(25)2011)128915(23)14(1012)22(26)27h810131723H27H21H3(H2202125)
MFCD00353353
O=C1NC(=C(C(N1)c1ccc(c(c1)(N+)(=O)(O))O)C(=O)OC1CCCCCC1)C
ZINC000035948779
ZINC000035948781
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