Vitas-M small molecule compound
3-(1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)phenyl 4-methylbenzenesulfonate
Catalog ID
STK269011
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1cccc(c1)N1C(=O)C2C(C1=O)C1CC2CC1
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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 C22H21NO5S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO5S/c1-13-5-9-18(10-6-13)29(26,27)28-17-4-2-3-16(12-17)23-21(24)19-14-7-8-15(11-14)20(19)22(23)25/h2-6,9-10,12,14-15,19-20H,7-8,11H2,1H3InChIKey
JNTCXBPGPSVBAU-UHFFFAOYSA-NSynonyms
3(13dioxooctahydro2H47methanoisoindol2yl)phenyl4methylbenzenesulfonate
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)N3C(=O)C4C5CCC(C5)C4C3=O
InChI=1SC22H21NO5Sc1135918(10613)29(2627)281742316(1217)2321(24)19147815(1114)20(19)22(23)25h269101214151920H7811H21H3
MFCD03015613
ZINC000100566976
ZINC000102634403
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