Vitas-M small molecule compound
3-[(E)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]-7-methoxyquinolin-2(1H)-one
Catalog ID
STK618223
SMILES COc1ccc2c(c1)[nH]c(=O)c(c2)/C=C\1/SC(=S)N(C1=O)Cc1ccccc1
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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 C21H16N2O3S2 MW 408.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O3S2/c1-26-16-8-7-14-9-15(19(24)22-17(14)11-16)10-18-20(25)23(21(27)28-18)12-13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,22,24)/b18-10+InChIKey
FYBJUXVCAOBWGV-VCHYOVAHSA-NSynonyms
(5E)3benzyl5((7methoxy2oxo1Hquinolin3yl)methylidene)2sulfanylidene13thiazolidin4one
3((E)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)7methoxyquinolin2(1H)one
COC1=CC2=C(C=C1)C=C(C(=O)N2)C=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4
COc1ccc2c(c1)(nH)c(=O)c(c2)C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC21H16N2O3S2c126168714915(19(24)2217(14)1116)101820(25)23(21(27)2818)12135324613h211H12H21H3(H2224)b1810+
MFCD18158746
ZINC000013729166
ZINC13729166
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