Vitas-M small molecule compound
(5Z)-5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-3-(pyridin-3-ylmethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK699261
SMILES S=C1S/C(=C\c2cc(n(c2C)c2cccnc2)C)/C(=O)N1Cc1cccnc1
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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 C21H18N4OS2 MW 406.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4OS2/c1-14-9-17(15(2)25(14)18-6-4-8-23-12-18)10-19-20(26)24(21(27)28-19)13-16-5-3-7-22-11-16/h3-12H,13H2,1-2H3/b19-10-InChIKey
ABPKAULRVBQTGX-GRSHGNNSSA-NSynonyms
(5Z)5((25dimethyl1(pyridin3yl)1Hpyrrol3yl)methylidene)3(pyridin3ylmethyl)2thioxo13thiazolidin4one
(5Z)5((25DIMETHYL1PYRIDIN3YLPYRROL3YL)METHYLIDENE)3(PYRIDIN3YLMETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
CC1=CC(=C(N1C2=CN=CC=C2)C)C=C3C(=O)N(C(=S)S3)CC4=CN=CC=C4
InChI=1SC21H18N4OS2c114917(15(2)25(14)18648231218)101920(26)24(21(27)2819)1316537221116h312H13H212H3b1910
MFCD03705250
S=C1SC(=Cc2cc(n(c2C)c2cccnc2)C)C(=O)N1Cc1cccnc1
ZINC000012445309
ZINC12445309
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