Vitas-M small molecule compound
(5Z)-5-{[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3,5-dimethyl-1H-pyrazol-4-yl]methylidene}-4-[(3-fluorophenyl)amino]-1,3-thiazol-2(5H)-one
Catalog ID
STL248441
SMILES O=C1S/C(=C\c2c(C)nn(c2C)C2CCS(=O)(=O)C2)/C(=N1)Nc1cccc(c1)F
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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 C19H19FN4O3S2 MW 434.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19FN4O3S2/c1-11-16(12(2)24(23-11)15-6-7-29(26,27)10-15)9-17-18(22-19(25)28-17)21-14-5-3-4-13(20)8-14/h3-5,8-9,15H,6-7,10H2,1-2H3,(H,21,22,25)/b17-9-InChIKey
JTYAHEHMLVKXBE-MFOYZWKCSA-NSynonyms
1351704-78-3(5Z)5((1(11dioxidotetrahydrothiophen3yl)35dimethyl1Hpyrazol4yl)methylidene)4((3fluorophenyl)amino)13thiazol2(5H)one
(5Z)5((1(11dioxothiolan3yl)35dimethylpyrazol4yl)methylidene)4(3fluoroanilino)13thiazol2one
(Z)5((1(11dioxidotetrahydrothiophen3yl)35dimethyl1Hpyrazol4yl)methylene)4((3fluorophenyl)amino)thiazol2(5H)one
1351704783
CC1=C(C(=NN1C2CCS(=O)(=O)C2)C)C=C3C(=NC(=O)S3)NC4=CC(=CC=C4)F
InChI=1SC19H19FN4O3S2c11116(12(2)24(2311)156729(2627)1015)91718(2219(25)2817)211453413(20)814h358915H6710H212H3(H212225)b179
MFCD20535996
O=C1SC(=Cc2c(C)nn(c2C)C2CCS(=O)(=O)C2)C(=N1)Nc1cccc(c1)F
ZINC000072400811
ZINC000072400812
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