Vitas-M small molecule compound
ethyl 4-(3-bromophenyl)-6-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL107607
SMILES CCOC(=O)C1=C(CN2CCC3(CC2)OCCO3)NC(=O)NC1c1cccc(c1)Br
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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 C21H26BrN3O5 MW 480.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26BrN3O5/c1-2-28-19(26)17-16(13-25-8-6-21(7-9-25)29-10-11-30-21)23-20(27)24-18(17)14-4-3-5-15(22)12-14/h3-5,12,18H,2,6-11,13H2,1H3,(H2,23,24,27)InChIKey
QSEVRXYJUCZOBK-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC(=CC=C2)Br)CN3CCC4(CC3)OCCO4
ethyl4(3bromophenyl)6(14dioxa8azaspiro(45)dec8ylmethyl)2oxo1234tetrahydropyrimidine5carboxylate
ethyl4(3bromophenyl)6(14dioxa8azaspiro(45)decan8ylmethyl)2oxo34dihydro1Hpyrimidine5carboxylate
InChI=1SC21H26BrN3O5c122819(26)1716(13258621(7925)2910113021)2320(27)2418(17)1443515(22)1214h351218H261113H21H3(H2232427)
MFCD20741543
ZINC000067286164
ZINC000067286166
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