Vitas-M small molecule compound
(4E)-2-(2,3-dichlorophenyl)-4-{[(1,1-dioxidotetrahydrothiophen-3-yl)amino]methylidene}isoquinoline-1,3(2H,4H)-dione
Catalog ID
STK575717
SMILES O=C1/C(=C/NC2CCS(=O)(=O)C2)/c2ccccc2C(=O)N1c1cccc(c1Cl)Cl
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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 C20H16Cl2N2O4S MW 451.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16Cl2N2O4S/c21-16-6-3-7-17(18(16)22)24-19(25)14-5-2-1-4-13(14)15(20(24)26)10-23-12-8-9-29(27,28)11-12/h1-7,10,12,23H,8-9,11H2/b15-10+InChIKey
PMTLYSJXNGQEHK-XNTDXEJSSA-NSynonyms
(4E)2(23dichlorophenyl)4(((11dioxidotetrahydrothiophen3yl)amino)methylidene)isoquinoline13(2H4H)dione
(4E)2(23dichlorophenyl)4(((11dioxothiolan3yl)amino)methylidene)isoquinoline13dione
(E)2(23dichlorophenyl)4(((11dioxidotetrahydrothiophen3yl)amino)methylene)isoquinoline13(2H4H)dione
C1CS(=O)(=O)CC1NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=C(C(=CC=C4)Cl)Cl
InChI=1SC20H16Cl2N2O4Sc211663717(18(16)22)2419(25)14521413(14)15(20(24)26)1023128929(2728)1112h17101223H8911H2b1510+
MFCD06601761
O=C1C(=CNC2CCS(=O)(=O)C2)c2ccccc2C(=O)N1c1cccc(c1Cl)Cl
ZINC000020518601
ZINC000020518603
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