Vitas-M small molecule compound
N-benzyl-4-{4-[(2-fluorobenzyl)oxy]-3-methoxyphenyl}-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL427003
SMILES COc1cc(ccc1OCc1ccccc1F)C1NC(=S)NC(=C1C(=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 C27H26FN3O3S MW 491.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26FN3O3S/c1-17-24(26(32)29-15-18-8-4-3-5-9-18)25(31-27(35)30-17)19-12-13-22(23(14-19)33-2)34-16-20-10-6-7-11-21(20)28/h3-14,25H,15-16H2,1-2H3,(H,29,32)(H2,30,31,35)InChIKey
DBTQNZDCKTXILC-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=S)N1)C2=CC(=C(C=C2)OCC3=CC=CC=C3F)OC)C(=O)NCC4=CC=CC=C4
InChI=1SC27H26FN3O3Sc11724(26(32)2915188435918)25(3127(35)3017)19121322(23(1419)332)34162010671121(20)28h31425H1516H212H3(H2932)(H2303135)
MFCD06136227
Nbenzyl4(4((2fluorobenzyl)oxy)3methoxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxamide
NBENZYL4(4((2FLUOROPHENYL)METHOXY)3METHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
ZINC000016425979
ZINC000016425982
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