Vitas-M small molecule compound
4-[5-(2,4-dimethylphenyl)-4,6-dioxo-2-phenylhexahydro-2H-pyrrolo[3,4-d][1,2]oxazol-3-yl]benzonitrile
Catalog ID
STL349398
SMILES N#Cc1ccc(cc1)C1N(OC2C1C(=O)N(C2=O)c1ccc(cc1C)C)c1ccccc1
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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 C26H21N3O3 MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O3/c1-16-8-13-21(17(2)14-16)28-25(30)22-23(19-11-9-18(15-27)10-12-19)29(32-24(22)26(28)31)20-6-4-3-5-7-20/h3-14,22-24H,1-2H3InChIKey
HPYXJYJECHFNPV-UHFFFAOYSA-NSynonyms
1023176-23-91023176239
4(5(24DIMETHYLPHENYL)46DIOXO2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOL3YL)BENZONITRILE
4(5(24dimethylphenyl)46dioxo2phenylhexahydro2Hpyrrolo(34d)(12)oxazol3yl)benzonitrile
4(5(24DIMETHYLPHENYL)46DIOXO2PHENYLHEXAHYDRO2HPYRROLO(34D)ISOXAZOL3YL)BENZONITRILE
CC1=CC(=C(C=C1)N2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)C#N)C
InChI=1SC26H21N3O3c11681321(17(2)1416)2825(30)2223(1911918(1527)101219)29(3224(22)26(28)31)206435720h3142224H12H3
MFCD05705491
ZINC000102768207
ZINC000230056892
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