Vitas-M small molecule compound
ethyl 3-{[(E)-(3-hexyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]amino}benzoate
Catalog ID
STK991438
SMILES CCCCCCN1C(=S)S/C(=C/Nc2cccc(c2)C(=O)OCC)/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 C19H24N2O3S2 MW 392.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24N2O3S2/c1-3-5-6-7-11-21-17(22)16(26-19(21)25)13-20-15-10-8-9-14(12-15)18(23)24-4-2/h8-10,12-13,20H,3-7,11H2,1-2H3/b16-13+InChIKey
HRRCOVCNDUDPNU-DTQAZKPQSA-NSynonyms
CCCCCCN1C(=O)C(=CNC2=CC=CC(=C2)C(=O)OCC)SC1=S
CCCCCCN1C(=S)SC(=CNc2cccc(c2)C(=O)OCC)C1=O
ETHYL3(((E)(3HEXYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)AMINO)BENZOATE
ethyl3(((E)(3hexyl4oxo2thioxo13thiazolidin5ylidene)methyl)amino)benzoate
InChI=1SC19H24N2O3S2c13567112117(22)16(2619(21)25)132015108914(1215)18(23)2442h810121320H3711H212H3b1613+
MFCD07801989
ZINC000005021805
ZINC05021805
ZINC5021805
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