Vitas-M small molecule compound

methyl 4-[3-(2,4-dichlorophenyl)-4,6-dioxo-2-phenylhexahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate

Catalog ID
STL020723
SMILES COC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C(N(O2)c1ccccc1)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 C25H18Cl2N2O5 MW 497.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18Cl2N2O5/c1-33-25(32)14-7-10-16(11-8-14)28-23(30)20-21(18-12-9-15(26)13-19(18)27)29(34-22(20)24(28)31)17-5-3-2-4-6-17/h2-13,20-22H,1H3
InChIKey
BHDBMIZMDLRZTN-UHFFFAOYSA-N
Synonyms
1005117-99-6
1005117996
COC(=O)C1=CC=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=C(C=C(C=C5)Cl)Cl
InChI=1SC25H18Cl2N2O5c13325(32)1471016(11814)2823(30)2021(1812915(26)1319(18)27)29(3422(20)24(28)31)175324617h2132022H1H3
METHYL4(3(24DICHLOROPHENYL)46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL5YL)BENZOATE
methyl4(3(24dichlorophenyl)46dioxo2phenylhexahydro5Hpyrrolo(34d)(12)oxazol5yl)benzoate
METHYL4(3(24DICHLOROPHENYL)46DIOXO2PHENYLTETRAHYDRO2HPYRROLO(34D)ISOXAZOL5(3H)YL)BENZOATE
MFCD04169237
ZINC000102745461
ZINC000238881772

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Available files

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