Vitas-M small molecule compound
(5Z)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-[3-methoxy-4-(3-methylbutoxy)benzylidene]-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK702047
SMILES COc1cc(ccc1OCCC(C)C)/C=C/1\SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C
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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 C27H29N3O4S2 MW 523.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O4S2/c1-17(2)13-14-34-21-12-11-19(15-22(21)33-5)16-23-25(31)29(27(35)36-23)24-18(3)28(4)30(26(24)32)20-9-7-6-8-10-20/h6-12,15-17H,13-14H2,1-5H3/b23-16-InChIKey
JVLCHPPGPJSUTD-KQWNVCNZSA-NSynonyms
(5Z)3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)5(3methoxy4(3methylbutoxy)benzylidene)2thioxo13thiazolidin4one
(5Z)3(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)5((3METHOXY4(3METHYLBUTOXY)PHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)5(4(isopentyloxy)3methoxybenzylidene)2thioxothiazolidin4one
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)C(=CC4=CC(=C(C=C4)OCCC(C)C)OC)SC3=S
COc1cc(ccc1OCCC(C)C)C=C1SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C
InChI=1SC27H29N3O4S2c117(2)13143421121119(1522(21)335)162325(31)29(27(35)3623)2418(3)28(4)30(26(24)32)2097681020h6121517H1314H215H3b2316
MFCD02990460
ZINC000001304962
ZINC01304962
ZINC1304962
Check stock
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