Vitas-M small molecule compound
4-(5-benzyl-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl)phenyl benzoate
Catalog ID
STL344443
SMILES O=C(c1ccccc1)Oc1ccc(cc1)C1C2C(=O)N(C(=O)C2ON1c1ccccc1)Cc1ccccc1
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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 C31H24N2O5 MW 504.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24N2O5/c34-29-26-27(22-16-18-25(19-17-22)37-31(36)23-12-6-2-7-13-23)33(24-14-8-3-9-15-24)38-28(26)30(35)32(29)20-21-10-4-1-5-11-21/h1-19,26-28H,20H2InChIKey
JJNKLCHCGHCRMY-UHFFFAOYSA-NSynonyms
1023568-64-0(4(5BENZYL46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)PHENYL)BENZOATE
1023568640
4(5benzyl46dioxo2phenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)phenylbenzoate
4(5benzyl46dioxo2phenylhexahydro2Hpyrrolo(34d)isoxazol3yl)phenylbenzoate
C1=CC=C(C=C1)CN2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)OC(=O)C6=CC=CC=C6
InChI=1SC31H24N2O5c34292627(22161825(191722)3731(36)23126271323)33(24148391524)3828(26)30(35)32(29)2021104151121h1192628H20H2
MFCD04176975
ZINC000018081480
ZINC000102749947
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