Vitas-M small molecule compound
1-methyl-3,7-bis[(4-methylphenyl)sulfonyl]-5-phenyl-3,7-diazabicyclo[3.3.1]nonan-9-one
Catalog ID
STL448096
SMILES Cc1ccc(cc1)S(=O)(=O)N1CC2(C)CN(CC(C1)(C2=O)c1ccccc1)S(=O)(=O)c1ccc(cc1)C
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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 C28H30N2O5S2 MW 538.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O5S2/c1-21-9-13-24(14-10-21)36(32,33)29-17-27(3)18-30(37(34,35)25-15-11-22(2)12-16-25)20-28(19-29,26(27)31)23-7-5-4-6-8-23/h4-16H,17-20H2,1-3H3InChIKey
WGXZCGJPBRVUQJ-UHFFFAOYSA-NSynonyms
1methyl37bis((4methylphenyl)sulfonyl)5phenyl37diazabicyclo(331)nonan9one
1METHYL37BIS(4METHYLPHENYL)SULFONYL5PHENYL37DIAZABICYCLO(331)NONAN9ONE
CC1=CC=C(C=C1)S(=O)(=O)N2CC3(CN(CC(C2)(C3=O)C4=CC=CC=C4)S(=O)(=O)C5=CC=C(C=C5)C)C
InChI=1SC28H30N2O5S2c12191324(141021)36(3233)291727(3)1830(37(3435)25151122(2)121625)2028(192926(27)31)237546823h416H1720H213H3
MFCD06177478
ZINC000008768062
ZINC8768062
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