Vitas-M small molecule compound
{3-[3-(3-methylbutyl)-1H-imidazol-3-ium-1-yl]-1,4-dioxo-1,4-dihydronaphthalen-2-yl}(phenylsulfonyl)azanide
Catalog ID
STL047040
SMILES CC(CC[n+]1ccn(c1)C1=C([N-]S(=O)(=O)c2ccccc2)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 C24H23N3O4S MW 449.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O4S/c1-17(2)12-13-26-14-15-27(16-26)22-21(25-32(30,31)18-8-4-3-5-9-18)23(28)19-10-6-7-11-20(19)24(22)29/h3-11,14-17H,12-13H2,1-2H3InChIKey
OYDCHMZVJGLEJZ-UHFFFAOYSA-NSynonyms
(3(3(3methylbutyl)1Himidazol3ium1yl)14dioxo14dihydronaphthalen2yl)(phenylsulfonyl)azanide
(3Z)2(3(3METHYLBUTYL)IMIDAZOL3IUM1YL)4OXIDANYLIDENE3(PHENYLSULFONYLIMINO)NAPHTHALEN1OLATE
(3Z)3(BENZENESULFONYLIMINO)2(3(3METHYLBUTYL)1IMIDAZOL3IUMYL)4OXO1NAPHTHALENOLATE
(3Z)3(BENZENESULFONYLIMINO)2(3(3METHYLBUTYL)IMIDAZOL3IUM1YL)4OXONAPHTHALEN1OLATE
(3Z)3BESYLIMINO2(3ISOAMYLIMIDAZOL3IUM1YL)4KETONAPHTHALEN1OLATE
2(3(3METHYLBUTYL)1HIMIDAZOL3IUM1YL)4OXO3((PHENYLSULFONYL)IMINO)34DIHYDRONAPHTHALEN1OLATE
3(BENZENESULFONYLIMINO)2(3(3METHYLBUTYL)IMIDAZOL3IUM1YL)4OXONAPHTHALEN1OLATE
CC(C)CC(N+)1=CN(C=C1)C2=C(C3=CC=CC=C3C(=O)C2=NS(=O)(=O)C4=CC=CC=C4)(O)
CC(CC(n+)1ccn(c1)C1=C((N)S(=O)(=O)c2ccccc2)C(=O)c2c(C1=O)cccc2)C
InChI=1SC24H23N3O4Sc117(2)121326141527(1626)2221(2532(3031)188435918)23(28)1910671120(19)24(22)29h3111417H1213H212H3
MFCD03812950
ZINC000013496731
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