Vitas-M small molecule compound
2-cyanoethyl 6-methyl-4-(3-nitrophenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK402422
SMILES N#CCCOC(=O)C1=C(C)NC(=O)NC1c1cccc(c1)[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 C15H14N4O5 MW 330.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N4O5/c1-9-12(14(20)24-7-3-6-16)13(18-15(21)17-9)10-4-2-5-11(8-10)19(22)23/h2,4-5,8,13H,3,7H2,1H3,(H2,17,18,21)InChIKey
FDJWIZXHXCVGGH-UHFFFAOYSA-NSynonyms
2CYANOETHYL4METHYL6(3NITROPHENYL)2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
2cyanoethyl6methyl4(3nitrophenyl)2oxo1234tetrahydropyrimidine5carboxylate
2CYANOETHYL6METHYL4(3NITROPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CC1=C(C(NC(=O)N1)C2=CC(=CC=C2)(N+)(=O)(O))C(=O)OCCC#N
InChI=1SC15H14N4O5c1912(14(20)2473616)13(1815(21)179)1042511(810)19(22)23h245813H37H21H3(H2171821)
MFCD01193387
N#CCCOC(=O)C1=C(C)NC(=O)NC1c1cccc(c1)(N+)(=O)(O)
ZINC000004491894
ZINC000004491895
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