Vitas-M small molecule compound
N-benzyl-4-{4-[(2-chloro-6-fluorobenzyl)oxy]phenyl}-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL427004
SMILES S=C1NC(=C(C(N1)c1ccc(cc1)OCc1c(F)cccc1Cl)C(=O)NCc1ccccc1)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 C26H23ClFN3O2S MW 496.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClFN3O2S/c1-16-23(25(32)29-14-17-6-3-2-4-7-17)24(31-26(34)30-16)18-10-12-19(13-11-18)33-15-20-21(27)8-5-9-22(20)28/h2-13,24H,14-15H2,1H3,(H,29,32)(H2,30,31,34)InChIKey
KPUQCSNHZZUZHD-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)OCC3=C(C=CC=C3Cl)F)C(=O)NCC4=CC=CC=C4
InChI=1SC26H23ClFN3O2Sc11623(25(32)2914176324717)24(3126(34)3016)18101219(131118)33152021(27)85922(20)28h21324H1415H21H3(H2932)(H2303134)
MFCD06136242
Nbenzyl4(4((2chloro6fluorobenzyl)oxy)phenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxamide
NBENZYL4(4((2CHLORO6FLUOROPHENYL)METHOXY)PHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
ZINC000016425277
ZINC000016425280
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