Vitas-M small molecule compound
prop-2-en-1-yl 4-[3-(4-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK798709
SMILES CCCCOc1ccc(cc1)c1nn(cc1C1NC(=O)NC(=C1C(=O)OCC=C)C)c1ccccc1
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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 C28H30N4O4 MW 486.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O4/c1-4-6-17-35-22-14-12-20(13-15-22)25-23(18-32(31-25)21-10-8-7-9-11-21)26-24(27(33)36-16-5-2)19(3)29-28(34)30-26/h5,7-15,18,26H,2,4,6,16-17H2,1,3H3,(H2,29,30,34)InChIKey
KGPJPSFKRLDWSP-UHFFFAOYSA-NSynonyms
CCCCOC1=CC=C(C=C1)C2=NN(C=C2C3C(=C(NC(=O)N3)C)C(=O)OCC=C)C4=CC=CC=C4
InChI=1SC28H30N4O4c146173522141220(131522)2523(1832(3125)21108791121)2624(27(33)361652)19(3)2928(34)3026h57151826H2461617H213H3(H2293034)
MFCD03462057
prop2en1yl4(3(4butoxyphenyl)1phenyl1Hpyrazol4yl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
PROP2ENYL4(3(4BUTOXYPHENYL)1PHENYLPYRAZOL4YL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ZINC000012614272
ZINC000012614277
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