Vitas-M small molecule compound
cyclopentyl 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK363313
SMILES CCOc1cc(cc(c1O)Br)C1NC(=O)N(C(=C1C(=O)OC1CCCC1)C)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 C20H25BrN2O5 MW 453.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25BrN2O5/c1-4-27-15-10-12(9-14(21)18(15)24)17-16(11(2)23(3)20(26)22-17)19(25)28-13-7-5-6-8-13/h9-10,13,17,24H,4-8H2,1-3H3,(H,22,26)InChIKey
MZZBBSFHRBZEOS-UHFFFAOYSA-NSynonyms
CCOC1=C(C(=CC(=C1)C2C(=C(N(C(=O)N2)C)C)C(=O)OC3CCCC3)Br)O
cyclopentyl4(3bromo5ethoxy4hydroxyphenyl)16dimethyl2oxo1234tetrahydropyrimidine5carboxylate
CYCLOPENTYL6(3BROMO5ETHOXY4HYDROXYPHENYL)34DIMETHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
CYCLOPENTYL6(3BROMO5ETHOXY4HYDROXYPHENYL)34DIMETHYL2OXO16DIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC20H25BrN2O5c1427151012(914(21)18(15)24)1716(11(2)23(3)20(26)2217)19(25)2813756813h910131724H48H213H3(H2226)
MFCD01133754
ZINC000004133601
ZINC000004133608
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