Vitas-M small molecule compound
ethyl 6-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-2-oxo-4-(thiophen-2-yl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STL028092
SMILES CCOC(=O)C1=C(CN2CCN(CC2)c2ccccc2F)NC(=O)NC1c1cccs1
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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 C22H25FN4O3S MW 444.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25FN4O3S/c1-2-30-21(28)19-16(24-22(29)25-20(19)18-8-5-13-31-18)14-26-9-11-27(12-10-26)17-7-4-3-6-15(17)23/h3-8,13,20H,2,9-12,14H2,1H3,(H2,24,25,29)InChIKey
IXBDCALHSQALDB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=CC=CS2)CN3CCN(CC3)C4=CC=CC=C4F
ethyl6((4(2fluorophenyl)piperazin1yl)methyl)2oxo4(thiophen2yl)1234tetrahydropyrimidine5carboxylate
ethyl6((4(2fluorophenyl)piperazin1yl)methyl)2oxo4thiophen2yl34dihydro1Hpyrimidine5carboxylate
InChI=1SC22H25FN4O3Sc123021(28)1916(2422(29)2520(19)1885133118)142691127(121026)17743615(17)23h381320H291214H21H3(H2242529)
MFCD14915011
ZINC000020559138
ZINC000020559140
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