Vitas-M small molecule compound
methyl 4-[({[(5E)-5-benzylidene-4-oxo-1-phenyl-4,5-dihydro-1H-imidazol-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL265257
SMILES COC(=O)c1ccc(cc1)NC(=O)CSC1=NC(=O)/C(=C\c2ccccc2)/N1c1ccccc1
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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 C26H21N3O4S MW 471.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O4S/c1-33-25(32)19-12-14-20(15-13-19)27-23(30)17-34-26-28-24(31)22(16-18-8-4-2-5-9-18)29(26)21-10-6-3-7-11-21/h2-16H,17H2,1H3,(H,27,30)/b22-16+InChIKey
CJOJJWZRIVKYQE-CJLVFECKSA-NSynonyms
COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=CC3=CC=CC=C3)N2C4=CC=CC=C4
COC(=O)c1ccc(cc1)NC(=O)CSC1=NC(=O)C(=Cc2ccccc2)N1c1ccccc1
InChI=1SC26H21N3O4Sc13325(32)19121420(151319)2723(30)1734262824(31)22(16188425918)29(26)21106371121h216H17H21H3(H2730)b2216+
methyl4(((((5E)5benzylidene4oxo1phenyl45dihydro1Himidazol2yl)sulfanyl)acetyl)amino)benzoate
METHYL4((2((5E)5BENZYLIDENE4OXO1PHENYLIMIDAZOL2YL)SULFANYLACETYL)AMINO)BENZOATE
MFCD02251888
ZINC000004531075
ZINC04531075
ZINC4531075
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