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-(prop-2-en-1-yloxy)benzylidene]-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK999645
SMILES C=CCOc1ccc(cc1OC)/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 C25H23N3O4S2 MW 493.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O4S2/c1-5-13-32-19-12-11-17(14-20(19)31-4)15-21-23(29)27(25(33)34-21)22-16(2)26(3)28(24(22)30)18-9-7-6-8-10-18/h5-12,14-15H,1,13H2,2-4H3/b21-15-
InChIKey
VWHKSUMLFSOJOG-QNGOZBTKSA-N
Synonyms
797017-49-3
(5Z)3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)5(3methoxy4(prop2en1yloxy)benzylidene)2thioxo13thiazolidin4one
(5Z)3(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)5((3METHOXY4PROP2ENOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5(4(allyloxy)3methoxybenzylidene)3(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)2thioxothiazolidin4one
797017493
C=CCOc1ccc(cc1OC)C=C1SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=O)C(=CC4=CC(=C(C=C4)OCC=C)OC)SC3=S
InChI=1SC25H23N3O4S2c15133219121117(1420(19)314)152123(29)27(25(33)3421)2216(2)26(3)28(24(22)30)1897681018h5121415H113H224H3b2115
MFCD03663247
ZINC000002365705
ZINC000026841892
ZINC02365705
ZINC2365705

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Available files

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