Vitas-M small molecule compound
methyl 4-[({1-[4-(ethoxycarbonyl)phenyl]-5-oxo-2-thioxo-3-[4-(trifluoromethoxy)benzyl]imidazolidin-4-yl}acetyl)amino]benzoate
Catalog ID
STK112724
SMILES CCOC(=O)c1ccc(cc1)N1C(=S)N(C(C1=O)CC(=O)Nc1ccc(cc1)C(=O)OC)Cc1ccc(cc1)OC(F)(F)F
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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 C30H26F3N3O7S MW 629.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26F3N3O7S/c1-3-42-28(40)20-8-12-22(13-9-20)36-26(38)24(16-25(37)34-21-10-6-19(7-11-21)27(39)41-2)35(29(36)44)17-18-4-14-23(15-5-18)43-30(31,32)33/h4-15,24H,3,16-17H2,1-2H3,(H,34,37)InChIKey
VDEZRAYGBXIORG-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(N(C2=S)CC3=CC=C(C=C3)OC(F)(F)F)CC(=O)NC4=CC=C(C=C4)C(=O)OC
InChI=1SC30H26F3N3O7Sc134228(40)2081222(13920)3626(38)24(1625(37)342110619(71121)27(39)412)35(29(36)44)171841423(15518)4330(3132)33h41524H31617H212H3(H3437)
METHYL4(((1(4(ETHOXYCARBONYL)PHENYL)5OXO2THIOXO3(4(TRIFLUOROMETHOXY)BENZYL)IMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
METHYL4((2(1(4ETHOXYCARBONYLPHENYL)5OXO2SULFANYLIDENE3((4(TRIFLUOROMETHOXY)PHENYL)METHYL)IMIDAZOLIDIN4YL)ACETYL)AMINO)BENZOATE
MFCD03941577
ZINC000097995424
ZINC000097995425
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