Vitas-M small molecule compound
cyclopentyl 4-[3-methoxy-2-(propan-2-yloxy)phenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK406529
SMILES COc1cccc(c1OC(C)C)C1NC(=O)NC(=C1C(=O)OC1CCCC1)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 C21H28N2O5 MW 388.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O5/c1-12(2)27-19-15(10-7-11-16(19)26-4)18-17(13(3)22-21(25)23-18)20(24)28-14-8-5-6-9-14/h7,10-12,14,18H,5-6,8-9H2,1-4H3,(H2,22,23,25)InChIKey
ICMRQXWMFBZAKV-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=O)N1)C2=C(C(=CC=C2)OC)OC(C)C)C(=O)OC3CCCC3
cyclopentyl4(3methoxy2(propan2yloxy)phenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
CYCLOPENTYL4(3METHOXY2PROPAN2YLOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CYCLOPENTYL6(3METHOXY2(METHYLETHOXY)PHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC21H28N2O5c112(2)271915(1071116(19)264)1817(13(3)2221(25)2318)20(24)2814856914h710121418H5689H214H3(H2222325)
MFCD06000580
ZINC000005049816
ZINC000005049818
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