Vitas-M small molecule compound
4-[2-(4-chlorophenyl)-4,6-dioxo-5-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]-2-methoxyphenyl benzoate
Catalog ID
STL049035
SMILES COc1cc(ccc1OC(=O)c1ccccc1)C1N(OC2C1C(=O)N(C2=O)c1ccccc1)c1ccc(cc1)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 C31H23ClN2O6 MW 554.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H23ClN2O6/c1-38-25-18-20(12-17-24(25)39-31(37)19-8-4-2-5-9-19)27-26-28(40-34(27)23-15-13-21(32)14-16-23)30(36)33(29(26)35)22-10-6-3-7-11-22/h2-18,26-28H,1H3InChIKey
GYJZEXAULJKPHL-UHFFFAOYSA-NSynonyms
(4(2(4CHLOROPHENYL)46DIOXO5PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)2METHOXYPHENYL)BENZOATE
4(2(4chlorophenyl)46dioxo5phenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)2methoxyphenylbenzoate
4(2(4chlorophenyl)46dioxo5phenylhexahydro2Hpyrrolo(34d)isoxazol3yl)2methoxyphenylbenzoate
COC1=C(C=CC(=C1)C2C3C(C(=O)N(C3=O)C4=CC=CC=C4)ON2C5=CC=C(C=C5)Cl)OC(=O)C6=CC=CC=C6
InChI=1SC31H23ClN2O6c138251820(121724(25)3931(37)198425919)272628(4034(27)23151321(32)141623)30(36)33(29(26)35)22106371122h2182628H1H3
MFCD04180300
ZINC000102885283
ZINC000227085243
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