Vitas-M small molecule compound
methyl 2-[2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-4,6-dioxohexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STL019623
SMILES COC(=O)c1c(sc(c1C)C)N1C(=O)C2C(C1=O)C(N(O2)c1ccc(cc1)Cl)c1ccc(cc1Cl)Cl
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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 C25H19Cl3N2O5S MW 565.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19Cl3N2O5S/c1-11-12(2)36-24(18(11)25(33)34-3)29-22(31)19-20(16-9-6-14(27)10-17(16)28)30(35-21(19)23(29)32)15-7-4-13(26)5-8-15/h4-10,19-21H,1-3H3InChIKey
WIVDQADKGXYRHZ-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)N2C(=O)C3C(N(OC3C2=O)C4=CC=C(C=C4)Cl)C5=C(C=C(C=C5)Cl)Cl)C
InChI=1SC25H19Cl3N2O5Sc11112(2)3624(18(11)25(33)343)2922(31)1920(169614(27)1017(16)28)30(3521(19)23(29)32)157413(26)5815h4101921H13H3
METHYL2(2(4CHLOROPHENYL)3(24DICHLOROPHENYL)46DIOXO3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL5YL)45DIMETHYLTHIOPHENE3CARBOXYLATE
methyl2(2(4chlorophenyl)3(24dichlorophenyl)46dioxohexahydro5Hpyrrolo(34d)(12)oxazol5yl)45dimethylthiophene3carboxylate
METHYL2(2(4CHLOROPHENYL)3(24DICHLOROPHENYL)46DIOXOHEXAHYDRO5HPYRROLO(34D)ISOXAZOL5YL)45DIMETHYLTHIOPHENE3CARBOXYLATE
MFCD02971097
ZINC000102860575
ZINC000245242006
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