Vitas-M small molecule compound
methyl 4-{(Z)-[1-(4-ethoxyphenyl)-5-oxo-2-thioxoimidazolidin-4-ylidene]methyl}benzoate
Catalog ID
STL369087
SMILES CCOc1ccc(cc1)N1C(=S)N/C(=C\c2ccc(cc2)C(=O)OC)/C1=O
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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 C20H18N2O4S MW 382.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O4S/c1-3-26-16-10-8-15(9-11-16)22-18(23)17(21-20(22)27)12-13-4-6-14(7-5-13)19(24)25-2/h4-12H,3H2,1-2H3,(H,21,27)/b17-12-InChIKey
JZLRESGAEINMRV-ATVHPVEESA-NSynonyms
CCOC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)C(=O)OC)NC2=S
CCOc1ccc(cc1)N1C(=S)NC(=Cc2ccc(cc2)C(=O)OC)C1=O
InChI=1SC20H18N2O4Sc13261610815(91116)2218(23)17(2120(22)27)12134614(7513)19(24)252h412H3H212H3(H2127)b1712
METHYL4((Z)(1(4ETHOXYPHENYL)5OXO2SULFANYLIDENEIMIDAZOLIDIN4YLIDENE)METHYL)BENZOATE
methyl4((Z)(1(4ethoxyphenyl)5oxo2thioxoimidazolidin4ylidene)methyl)benzoate
MFCD03138397
ZINC000004754635
ZINC04754635
ZINC4754635
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