Vitas-M small molecule compound
7-methoxy-3-[(E)-{3-[3-(morpholin-4-yl)propyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}methyl]quinolin-2(1H)-one
Catalog ID
STK630642
SMILES COc1ccc2c(c1)[nH]c(=O)c(c2)/C=C\1/SC(=S)N(C1=O)CCCN1CCOCC1
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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 C21H23N3O4S2 MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O4S2/c1-27-16-4-3-14-11-15(19(25)22-17(14)13-16)12-18-20(26)24(21(29)30-18)6-2-5-23-7-9-28-10-8-23/h3-4,11-13H,2,5-10H2,1H3,(H,22,25)/b18-12+InChIKey
NNXOTIULISFCND-LDADJPATSA-NSynonyms
(5E)5((7methoxy2oxo1Hquinolin3yl)methylidene)3(3morpholin4ylpropyl)2sulfanylidene13thiazolidin4one
7methoxy3((E)(3(3(morpholin4yl)propyl)4oxo2thioxo13thiazolidin5ylidene)methyl)quinolin2(1H)one
COC1=CC2=C(C=C1)C=C(C(=O)N2)C=C3C(=O)N(C(=S)S3)CCCN4CCOCC4
COc1ccc2c(c1)(nH)c(=O)c(c2)C=C1SC(=S)N(C1=O)CCCN1CCOCC1
InChI=1SC21H23N3O4S2c1271643141115(19(25)2217(14)1316)121820(26)24(21(29)3018)62523792810823h341113H2510H21H3(H2225)b1812+
MFCD18159412
ZINC000013688698
ZINC13688698
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