Vitas-M small molecule compound
3-(2-chlorophenyl)-5-cyclohexyl-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Catalog ID
STL347539
SMILES O=C1N(C2CCCCC2)C(=O)C2C1C(=NO2)c1ccccc1Cl
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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 C17H17ClN2O3 MW 332.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN2O3/c18-12-9-5-4-8-11(12)14-13-15(23-19-14)17(22)20(16(13)21)10-6-2-1-3-7-10/h4-5,8-10,13,15H,1-3,6-7H2InChIKey
JDIMHHOJBXBUIB-UHFFFAOYSA-NSynonyms
(3aR6aS)3(2chlorophenyl)5cyclohexyl3aHpyrrolo(34d)isoxazole46(5H6aH)dione
3(2CHLOROPHENYL)5CYCLOHEXYL3A6ADIHYDROPYRROLO(34D)(12)OXAZOLE46DIONE
3(2chlorophenyl)5cyclohexyl3aHpyrrolo(34d)(12)oxazole46(5H6aH)dione
C1CCC(CC1)N2C(=O)C3C(C2=O)ON=C3C4=CC=CC=C4Cl
InChI=1SC17H17ClN2O3c1812954811(12)141315(231914)17(22)20(16(13)21)106213710h458101315H1367H2
MFCD28032264
O=C1N(C2CCCCC2)C(=O)(C@@H)2(C@H)1C(=NO2)c1ccccc1Cl
ZINC000101194072
ZINC000101360729
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