Vitas-M small molecule compound
{1,4-dioxo-3-[3-(propan-2-yl)-1H-imidazol-3-ium-1-yl]-1,4-dihydronaphthalen-2-yl}[(4-methylphenyl)sulfonyl]azanide
Catalog ID
STK563564
SMILES Cc1ccc(cc1)S(=O)(=O)[N-]C1=C(n2cc[n+](c2)C(C)C)C(=O)c2c(C1=O)cccc2
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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 C23H21N3O4S MW 435.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O4S/c1-15(2)25-12-13-26(14-25)21-20(22(27)18-6-4-5-7-19(18)23(21)28)24-31(29,30)17-10-8-16(3)9-11-17/h4-15H,1-3H3InChIKey
LAPGLDLXXBEQNK-UHFFFAOYSA-NSynonyms
1037565-25-5(14dioxo3(3(propan2yl)1Himidazol3ium1yl)14dihydronaphthalen2yl)((4methylphenyl)sulfonyl)azanide
(3Z)3(4methylphenyl)sulfonylimino4oxo2(3propan2ylimidazol3ium1yl)naphthalen1olate
1037565255
3(((4METHYLPHENYL)SULFONYL)IMINO)4OXO2(3(PROPAN2YL)1HIMIDAZOL3IUM1YL)34DIHYDRONAPHTHALEN1OLATE
3(4METHYLPHENYL)SULFONYLIMINO4OXO2(3PROPAN2YLIMIDAZOL3IUM1YL)NAPHTHALEN1OLATE
CC1=CC=C(C=C1)S(=O)(=O)N=C2C(=C(C3=CC=CC=C3C2=O)(O))N4C=C(N+)(=C4)C(C)C
Cc1ccc(cc1)S(=O)(=O)(N)C1=C(n2cc(n+)(c2)C(C)C)C(=O)c2c(C1=O)cccc2
InChI=1SC23H21N3O4Sc115(2)25121326(1425)2120(22(27)18645719(18)23(21)28)2431(2930)1710816(3)91117h415H13H3
MFCD03797244
ZINC000013582520
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