Vitas-M small molecule compound
(5Z)-3-{[(3-chloro-2-methylphenyl)amino]methyl}-5-[4-(propan-2-yl)benzylidene]-1,3-thiazolidine-2,4-dione
Catalog ID
STL443121
SMILES O=C1S/C(=C\c2ccc(cc2)C(C)C)/C(=O)N1CNc1cccc(c1C)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 C21H21ClN2O2S MW 400.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O2S/c1-13(2)16-9-7-15(8-10-16)11-19-20(25)24(21(26)27-19)12-23-18-6-4-5-17(22)14(18)3/h4-11,13,23H,12H2,1-3H3/b19-11-InChIKey
DLEDWBZCCLCHRZ-ODLFYWEKSA-NSynonyms
(5Z)3(((3chloro2methylphenyl)amino)methyl)5(4(propan2yl)benzylidene)13thiazolidine24dione
(5Z)3((3chloro2methylanilino)methyl)5((4propan2ylphenyl)methylidene)13thiazolidine24dione
CC1=C(C=CC=C1Cl)NCN2C(=O)C(=CC3=CC=C(C=C3)C(C)C)SC2=O
InChI=1SC21H21ClN2O2Sc113(2)169715(81016)111920(25)24(21(26)2719)12231864517(22)14(18)3h4111323H12H213H3b1911
MFCD30712407
O=C1SC(=Cc2ccc(cc2)C(C)C)C(=O)N1CNc1cccc(c1C)Cl
ZINC000103375061
ZINC103375061
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