Vitas-M small molecule compound
4-[4-(benzyloxy)phenyl]-N-(4-chlorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Catalog ID
STL426995
SMILES S=C1NC(=C(C(N1)c1ccc(cc1)OCc1ccccc1)C(=O)Nc1ccc(cc1)Cl)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 C25H22ClN3O2S MW 463.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O2S/c1-16-22(24(30)28-20-11-9-19(26)10-12-20)23(29-25(32)27-16)18-7-13-21(14-8-18)31-15-17-5-3-2-4-6-17/h2-14,23H,15H2,1H3,(H,28,30)(H2,27,29,32)InChIKey
UVESGCBLMBFRPY-UHFFFAOYSA-NSynonyms
4(4(benzyloxy)phenyl)N(4chlorophenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxamide
CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Cl
InChI=1SC25H22ClN3O2Sc11622(24(30)282011919(26)101220)23(2925(32)2716)1871321(14818)3115175324617h21423H15H21H3(H2830)(H2272932)
MFCD06136095
N(4CHLOROPHENYL)6METHYL4(4PHENYLMETHOXYPHENYL)2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXAMIDE
ZINC000016426269
ZINC000016426272
ZINC16426269
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