Vitas-M small molecule compound

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

Catalog ID
STK601068
SMILES Brc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)ON=C2C1=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 C20H13BrN2O4 MW 425.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13BrN2O4/c21-13-5-7-14(8-6-13)23-19(24)16-17(22-27-18(16)20(23)25)12-9-11-3-1-2-4-15(11)26-10-12/h1-9,16,18H,10H2/t16-,18+/m0/s1
InChIKey
VFIVYFIYOVIHGP-FUHWJXTLSA-N
Synonyms
1014063-63-8
(3aS6aR)5(4bromophenyl)3(2Hchromen3yl)3a6adihydropyrrolo(34d)(12)oxazole46dione
(3aS6aR)5(4bromophenyl)3(2Hchromen3yl)3aHpyrrolo(34d)(12)oxazole46(5H6aH)dione
(3aS6aR)5(4bromophenyl)3(2Hchromen3yl)3aHpyrrolo(34d)isoxazole46(5H6aH)dione
1014063638
Brc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)ON=C2C1=Cc2c(OC1)cccc2
C1C(=CC2=CC=CC=C2O1)C3=NOC4C3C(=O)N(C4=O)C5=CC=C(C=C5)Br
InChI=1SC20H13BrN2O4c21135714(8613)2319(24)1617(222718(16)20(23)25)12911312415(11)261012h191618H10H2t1618+m0s1
MFCD18246141
ZINC000009409954
ZINC09409954
ZINC9409954

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Available files

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