Vitas-M small molecule compound

(3aS,6aR)-3-(2H-chromen-3-yl)-5-(2-phenylethyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione

Catalog ID
STK615552
SMILES O=C1[C@@H]2ON=C([C@@H]2C(=O)N1CCc1ccccc1)C1=Cc2c(OC1)cccc2

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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 C22H18N2O4 MW 374.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O4/c25-21-18-19(16-12-15-8-4-5-9-17(15)27-13-16)23-28-20(18)22(26)24(21)11-10-14-6-2-1-3-7-14/h1-9,12,18,20H,10-11,13H2/t18-,20+/m0/s1
InChIKey
BDOHGGDSNIMAIJ-AZUAARDMSA-N
Synonyms
1212126-33-4
(3aS6aR)3(2Hchromen3yl)5(2phenylethyl)3a6adihydropyrrolo(34d)(12)oxazole46dione
(3aS6aR)3(2Hchromen3yl)5(2phenylethyl)3aHpyrrolo(34d)(12)oxazole46(5H6aH)dione
(3AS6AR)3(2HCHROMEN3YL)5PHENETHYL3A6ADIHYDROPYRROLO(34D)(12)OXAZOLE46DIONE
(3aS6aR)3(2Hchromen3yl)5phenethyl3aHpyrrolo(34d)isoxazole46(5H6aH)dione
1212126334
C1C(=CC2=CC=CC=C2O1)C3=NOC4C3C(=O)N(C4=O)CCC5=CC=CC=C5
InChI=1SC22H18N2O4c25211819(161215845917(15)271316)232820(18)22(26)24(21)1110146213714h19121820H101113H2t1820+m0s1
MFCD18246322
O=C1(C@@H)2ON=C((C@@H)2C(=O)N1CCc1ccccc1)C1=Cc2c(OC1)cccc2
ZINC000006669435
ZINC06669435
ZINC6669435

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Available files

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