Vitas-M small molecule compound
ethyl 1-({(5E)-5-[4-(dimethylamino)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}methyl)piperidine-4-carboxylate
Catalog ID
STK538527
SMILES CCOC(=O)C1CCN(CC1)CN1C(=S)S/C(=C/c2ccc(cc2)N(C)C)/C1=O
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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 C21H27N3O3S2 MW 433.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O3S2/c1-4-27-20(26)16-9-11-23(12-10-16)14-24-19(25)18(29-21(24)28)13-15-5-7-17(8-6-15)22(2)3/h5-8,13,16H,4,9-12,14H2,1-3H3/b18-13+InChIKey
IULCEPZGMPAXGC-QGOAFFKASA-NSynonyms
(E)ethyl1((5(4(dimethylamino)benzylidene)4oxo2thioxothiazolidin3yl)methyl)piperidine4carboxylate
CCOC(=O)C1CCN(CC1)CN1C(=S)SC(=Cc2ccc(cc2)N(C)C)C1=O
CCOC(=O)C1CCN(CC1)CN2C(=O)C(=CC3=CC=C(C=C3)N(C)C)SC2=S
ethyl1(((5E)5((4(dimethylamino)phenyl)methylidene)4oxo2sulfanylidene13thiazolidin3yl)methyl)piperidine4carboxylate
ETHYL1(((5E)5((4DIMETHYLAMINOPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)METHYL)PIPERIDINE4CARBOXYLATE
ethyl1(((5E)5(4(dimethylamino)benzylidene)4oxo2thioxo13thiazolidin3yl)methyl)piperidine4carboxylate
InChI=1SC21H27N3O3S2c142720(26)1691123(121016)142419(25)18(2921(24)28)13155717(8615)22(2)3h581316H491214H213H3b1813+
MFCD02924184
ZINC000020028748
ZINC20028748
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