Vitas-M small molecule compound

2-(1,3-benzothiazol-2-yl)-5-(4-fluorobenzyl)-4-methyl-1H-pyrazolo[4,3-c]pyridine-3,6(2H,5H)-dione

Catalog ID
STK513589
SMILES Fc1ccc(cc1)Cn1c(=O)cc2c(c1C)c(=O)n([nH]2)c1nc2c(s1)cccc2

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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 C21H15FN4O2S MW 406.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15FN4O2S/c1-12-19-16(10-18(27)25(12)11-13-6-8-14(22)9-7-13)24-26(20(19)28)21-23-15-4-2-3-5-17(15)29-21/h2-10,24H,11H2,1H3
InChIKey
JJMFYQBTSWQGKO-UHFFFAOYSA-N
Synonyms

2(13benzothiazol2yl)5((4fluorophenyl)methyl)4methyl1Hpyrazolo(43c)pyridine36dione
2(13benzothiazol2yl)5(4fluorobenzyl)4methyl1Hpyrazolo(43c)pyridine36(2H5H)dione
CC1=C2C(=CC(=O)N1CC3=CC=C(C=C3)F)NN(C2=O)C4=NC5=CC=CC=C5S4
Fc1ccc(cc1)Cn1c(=O)cc2c(c1C)c(=O)n((nH)2)c1nc2c(s1)cccc2
InChI=1SC21H15FN4O2Sc1121916(1018(27)25(12)11136814(22)9713)2426(20(19)28)212315423517(15)2921h21024H11H21H3
MFCD13370374
ZINC000030822906
ZINC12389658
ZINC30822906

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Available files

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