Vitas-M small molecule compound
(4E)-4-{[(1,1-dioxidotetrahydrothiophen-3-yl)amino]methylidene}-2-(2,4,6-trimethylphenyl)isoquinoline-1,3(2H,4H)-dione
Catalog ID
STK587575
SMILES Cc1cc(C)c(c(c1)C)N1C(=O)/C(=C/NC2CCS(=O)(=O)C2)/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 C23H24N2O4S MW 424.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O4S/c1-14-10-15(2)21(16(3)11-14)25-22(26)19-7-5-4-6-18(19)20(23(25)27)12-24-17-8-9-30(28,29)13-17/h4-7,10-12,17,24H,8-9,13H2,1-3H3/b20-12+InChIKey
GFUYIYSWMUOKPN-UDWIEESQSA-NSynonyms
(4E)4(((11dioxidotetrahydrothiophen3yl)amino)methylidene)2(246trimethylphenyl)isoquinoline13(2H4H)dione
(4E)4(((11dioxothiolan3yl)amino)methylidene)2(246trimethylphenyl)isoquinoline13dione
(E)4(((11dioxidotetrahydrothiophen3yl)amino)methylene)2mesitylisoquinoline13(2H4H)dione
CC1=CC(=C(C(=C1)C)N2C(=O)C3=CC=CC=C3C(=CNC4CCS(=O)(=O)C4)C2=O)C
Cc1cc(C)c(c(c1)C)N1C(=O)C(=CNC2CCS(=O)(=O)C2)c2c(C1=O)cccc2
InChI=1SC23H24N2O4Sc1141015(2)21(16(3)1114)2522(26)19754618(19)20(23(25)27)1224178930(2829)1317h4710121724H8913H213H3b2012+
MFCD06613162
ZINC000020533498
ZINC000020533499
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