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{3-[3-(3-methylbutyl)-1H-imidazol-3-ium-1-yl]-1,4-dioxo-1,4-dihydronaphthalen-2-yl}[(4-methylphenyl)sulfonyl]azanide

Catalog ID
STL038922
SMILES CC(CC[n+]1ccn(c1)C1=C([N-]S(=O)(=O)c2ccc(cc2)C)C(=O)c2c(C1=O)cccc2)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 C25H25N3O4S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O4S/c1-17(2)12-13-27-14-15-28(16-27)23-22(24(29)20-6-4-5-7-21(20)25(23)30)26-33(31,32)19-10-8-18(3)9-11-19/h4-11,14-17H,12-13H2,1-3H3
InChIKey
YCGPEXYEZIEOKG-UHFFFAOYSA-N
Synonyms

(3(3(3methylbutyl)1Himidazol3ium1yl)14dioxo14dihydronaphthalen2yl)((4methylphenyl)sulfonyl)azanide
(3Z)2(3(3METHYLBUTYL)1IMIDAZOL3IUMYL)3(4METHYLPHENYL)SULFONYLIMINO4OXO1NAPHTHALENOLATE
(3Z)2(3(3METHYLBUTYL)IMIDAZOL3IUM1YL)3(4METHYLPHENYL)SULFONYLIMINO4OXIDANYLIDENENAPHTHALEN1OLATE
(3Z)2(3(3METHYLBUTYL)IMIDAZOL3IUM1YL)3(4METHYLPHENYL)SULFONYLIMINO4OXONAPHTHALEN1OLATE
(3Z)2(3ISOAMYLIMIDAZOL3IUM1YL)4KETO3TOSYLIMINONAPHTHALEN1OLATE
2(3(3METHYLBUTYL)1HIMIDAZOL3IUM1YL)3(((4METHYLPHENYL)SULFONYL)IMINO)4OXO34DIHYDRONAPHTHALEN1OLATE
2(3(3METHYLBUTYL)IMIDAZOL3IUM1YL)3(4METHYLPHENYL)SULFONYLIMINO4OXONAPHTHALEN1OLATE
CC(CC(n+)1ccn(c1)C1=C((N)S(=O)(=O)c2ccc(cc2)C)C(=O)c2c(C1=O)cccc2)C
CC1=CC=C(C=C1)S(=O)(=O)N=C2C(=C(C3=CC=CC=C3C2=O)(O))N4C=C(N+)(=C4)CCC(C)C
InChI=1SC25H25N3O4Sc117(2)121327141528(1627)2322(24(29)20645721(20)25(23)30)2633(3132)1910818(3)91119h4111417H1213H213H3
MFCD03807175
ZINC000017145593
ZINC09042687

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Available files

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