Vitas-M small molecule compound

1,5-diethyl-3,7-bis[(4-methylphenyl)sulfonyl]-3,7-diazabicyclo[3.3.1]nonan-9-one

Catalog ID
STK830994
SMILES CCC12CN(CC(C2=O)(CN(C1)S(=O)(=O)c1ccc(cc1)C)CC)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 C25H32N2O5S2 MW 504.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N2O5S2/c1-5-24-15-26(33(29,30)21-11-7-19(3)8-12-21)17-25(6-2,23(24)28)18-27(16-24)34(31,32)22-13-9-20(4)10-14-22/h7-14H,5-6,15-18H2,1-4H3
InChIKey
WODURAAQMWOJMW-UHFFFAOYSA-N
Synonyms
381684-62-4
(1s5s)15diethyl37ditosyl37diazabicyclo(331)nonan9one
15diethyl37bis((4methylphenyl)sulfonyl)37diazabicyclo(331)nonan9one
15DIETHYL37BIS(4METHYLPHENYL)SULFONYL37DIAZABICYCLO(331)NONAN9ONE
15DIETHYL37BIS(TOLUENE4SULFONYL)37DIAZABICYCLO(331)NONAN9ONE
381684624
CCC12CN(CC(C1=O)(CN(C2)S(=O)(=O)C3=CC=C(C=C3)C)CC)S(=O)(=O)C4=CC=C(C=C4)C
InChI=1SC25H32N2O5S2c15241526(33(2930)2111719(3)81221)1725(6223(24)28)1827(1624)34(3132)2213920(4)101422h714H561518H214H3
MFCD02955970
ZINC000001017239
ZINC01017239
ZINC1017239

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Available files

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