Vitas-M small molecule compound
(2Z)-2-{[1-acetyl-3-(4-fluorophenyl)-1H-pyrazol-4-yl]methylidene}-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Catalog ID
STK765488
SMILES Fc1ccc(cc1)c1nn(cc1/C=c/1\sc2n(c1=O)c1c(n2)cc(c(c1)C)C)C(=O)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 C23H17FN4O2S MW 432.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17FN4O2S/c1-12-8-18-19(9-13(12)2)28-22(30)20(31-23(28)25-18)10-16-11-27(14(3)29)26-21(16)15-4-6-17(24)7-5-15/h4-11H,1-3H3/b20-10-InChIKey
KLXUJSHYJJEBIU-JMIUGGIZSA-NSynonyms
(2Z)2((1acetyl3(4fluorophenyl)1Hpyrazol4yl)methylidene)67dimethyl(13)thiazolo(32a)benzimidazol3(2H)one
(2Z)2((1ACETYL3(4FLUOROPHENYL)PYRAZOL4YL)METHYLIDENE)67DIMETHYL(13)THIAZOLO(32A)BENZIMIDAZOL1ONE
CC1=CC2=C(C=C1C)N3C(=O)C(=CC4=CN(N=C4C5=CC=C(C=C5)F)C(=O)C)SC3=N2
Fc1ccc(cc1)c1nn(cc1C=c1sc2n(c1=O)c1c(n2)cc(c(c1)C)C)C(=O)C
InChI=1SC23H17FN4O2Sc11281819(913(12)2)2822(30)20(3123(28)2518)10161127(14(3)29)2621(16)154617(24)7515h411H13H3b2010
MFCD03035634
ZINC000012446773
ZINC12446773
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