Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-5-(2-chlorobenzyl)-4-methyl-3-oxo-3,5-dihydro-2H-pyrazolo[4,3-c]pyridin-6-olate
Catalog ID
STK206743
SMILES Clc1ccccc1Cn1c([O-])cc2c(c1C)c(=O)n(n2)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 C21H14ClN4O2S MW 421.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15ClN4O2S/c1-12-19-16(10-18(27)25(12)11-13-6-2-3-7-14(13)22)24-26(20(19)28)21-23-15-8-4-5-9-17(15)29-21/h2-10,27H,11H2,1H3/p-1InChIKey
QEYDEAQRNICPEP-UHFFFAOYSA-MSynonyms
2(13BENZOTHIAZOL2YL)5((2CHLOROPHENYL)METHYL)4METHYL3OXOPYRAZOLO(43C)PYRIDIN6OLATE
2(13benzothiazol2yl)5(2chlorobenzyl)4methyl3oxo35dihydro2Hpyrazolo(43c)pyridin6olate
CC1=C2C(=NN(C2=O)C3=NC4=CC=CC=C4S3)C=C(N1CC5=CC=CC=C5Cl)(O)
Clc1ccccc1Cn1c((O))cc2c(c1C)c(=O)n(n2)c1nc2c(s1)cccc2
InChI=1SC21H15ClN4O2Sc1121916(1018(27)25(12)1113623714(13)22)2426(20(19)28)212315845917(15)2921h21027H11H21H3p1
ZINC000002400270
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