Vitas-M small molecule compound
(3aR,6aS)-5-(3,4-dichlorophenyl)-3-(2,5-dimethoxyphenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Catalog ID
STL007458
SMILES COc1ccc(c(c1)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(c(c1)Cl)Cl)OC
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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 C19H14Cl2N2O5 MW 421.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14Cl2N2O5/c1-26-10-4-6-14(27-2)11(8-10)16-15-17(28-22-16)19(25)23(18(15)24)9-3-5-12(20)13(21)7-9/h3-8,15,17H,1-2H3/t15-,17+/m1/s1InChIKey
ZQMDGDPYCDZGDY-WBVHZDCISA-NSynonyms
1212130-43-2(3aR6aS)5(34dichlorophenyl)3(25dimethoxyphenyl)3a6adihydropyrrolo(34d)(12)oxazole46dione
(3aR6aS)5(34dichlorophenyl)3(25dimethoxyphenyl)3aHpyrrolo(34d)(12)oxazole46(5H6aH)dione
(3aR6aS)5(34dichlorophenyl)3(25dimethoxyphenyl)3aHpyrrolo(34d)isoxazole46(5H6aH)dione
1212130432
COC1=CC(=C(C=C1)OC)C2=NOC3C2C(=O)N(C3=O)C4=CC(=C(C=C4)Cl)Cl
COc1ccc(c(c1)C1=NO(C@H)2(C@@H)1C(=O)N(C2=O)c1ccc(c(c1)Cl)Cl)OC
InChI=1SC19H14Cl2N2O5c126104614(272)11(810)161517(282216)19(25)23(18(15)24)93512(20)13(21)79h381517H12H3t1517+m1s1
MFCD18247170
ZINC000101311263
ZINC101311263
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