Vitas-M small molecule compound
3-butyl-5-(4-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6(3H,5H)-dione
Catalog ID
STK556229
SMILES CCCCC1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)[N+](=O)[O-])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 C21H21N3O5 MW 395.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O5/c1-2-3-9-17-18-19(29-23(17)15-7-5-4-6-8-15)21(26)22(20(18)25)14-10-12-16(13-11-14)24(27)28/h4-8,10-13,17-19H,2-3,9H2,1H3InChIKey
RKROBLKADFNWMV-UHFFFAOYSA-NSynonyms
1008866-89-41008866894
3BUTYL5(4NITROPHENYL)2PHENYL3A6ADIHYDRO3HPYRROLO(34D)(12)OXAZOLE46DIONE
3butyl5(4nitrophenyl)2phenyldihydro2Hpyrrolo(34d)(12)oxazole46(3H5H)dione
3butyl5(4nitrophenyl)2phenyldihydro2Hpyrrolo(34d)isoxazole46(5H6aH)dione
CCCCC1C2C(C(=O)N(C2=O)C3=CC=C(C=C3)(N+)(=O)(O))ON1C4=CC=CC=C4
CCCCC1N(OC2C1C(=O)N(C2=O)c1ccc(cc1)(N+)(=O)(O))c1ccccc1
InChI=1SC21H21N3O5c1239171819(2923(17)157546815)21(26)22(20(18)25)14101216(131114)24(27)28h4810131719H239H21H3
MFCD04016516
ZINC000018158200
ZINC000226986499
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