Vitas-M small molecule compound

ethyl 4-{2-(4-chlorophenyl)-3-[4-(dimethylamino)phenyl]-4,6-dioxohexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl}benzoate

Catalog ID
STL020349
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccc(cc1)Cl)c1ccc(cc1)N(C)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 C28H26ClN3O5 MW 519.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClN3O5/c1-4-36-28(35)18-7-13-21(14-8-18)31-26(33)23-24(17-5-11-20(12-6-17)30(2)3)32(37-25(23)27(31)34)22-15-9-19(29)10-16-22/h5-16,23-25H,4H2,1-3H3
InChIKey
SWBOOCXVDUTPMY-UHFFFAOYSA-N
Synonyms
612046-44-3
612046443
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)N(C)C
ethyl4(2(4chlorophenyl)3(4(dimethylamino)phenyl)46dioxo3a6adihydro3Hpyrrolo(34d)(12)oxazol5yl)benzoate
ethyl4(2(4chlorophenyl)3(4(dimethylamino)phenyl)46dioxohexahydro5Hpyrrolo(34d)(12)oxazol5yl)benzoate
ETHYL4(2(4CHLOROPHENYL)3(4(DIMETHYLAMINO)PHENYL)46DIOXOTETRAHYDRO2HPYRROLO(34D)ISOXAZOL5(3H)YL)BENZOATE
ETHYL4(2(4CHLOROPHENYL)3(4DIMETHYLAMINOPHENYL)46DIOXO3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL5YL)BENZOATE
InChI=1SC28H26ClN3O5c143628(35)1871321(14818)3126(33)2324(1751120(12617)30(2)3)32(3725(23)27(31)34)2215919(29)101622h5162325H4H213H3
MFCD02971137
ZINC000102860672
ZINC000238937035

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Available files

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