Vitas-M small molecule compound
3-(4-chlorophenyl)-6-(2,6-dimethylphenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Catalog ID
STK782928
SMILES Clc1ccc(cc1)C1=NOC2C1C1CC2C2C1C(=O)N(C2=O)c1c(C)cccc1C
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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 C24H21ClN2O3 MW 420.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClN2O3/c1-11-4-3-5-12(2)21(11)27-23(28)17-15-10-16(18(17)24(27)29)22-19(15)20(26-30-22)13-6-8-14(25)9-7-13/h3-9,15-19,22H,10H2,1-2H3InChIKey
BIMUPEXFTASKMN-UHFFFAOYSA-NSynonyms
(3aS4S4aR7aS8S8aS)3(4chlorophenyl)6(26dimethylphenyl)44a88atetrahydro3aH48methanoisoxazolo(45f)isoindole57(6H7aH)dione
3(4CHLOROPHENYL)6(26DIMETHYLPHENYL)4A7A88ATETRAHYDRO3AH48METHANO(12)OXAZOLO(45F)ISOINDOLE57(4H6H)DIONE
CC1=C(C(=CC=C1)C)N2C(=O)C3C4CC(C3C2=O)C5C4C(=NO5)C6=CC=C(C=C6)Cl
Clc1ccc(cc1)C1=NO(C@@H)2(C@H)1(C@@H)1C(C@H)2(C@H)2(C@@H)1C(=O)N(C2=O)c1c(C)cccc1C
InChI=1SC24H21ClN2O3c11143512(2)21(11)2723(28)17151016(18(17)24(27)29)2219(15)20(263022)136814(25)9713h39151922H10H212H3
MFCD06617234
ZINC000103023292
ZINC000247853141
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