Vitas-M small molecule compound
(4E)-4-{[(6-chloro-1,3-benzothiazol-2-yl)amino]methylidene}-2-(3,4-dimethylphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL295725
SMILES Clc1ccc2c(c1)sc(n2)N/C=C/1\C(=NN(C1=O)c1ccc(c(c1)C)C)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 C20H17ClN4OS MW 396.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN4OS/c1-11-4-6-15(8-12(11)2)25-19(26)16(13(3)24-25)10-22-20-23-17-7-5-14(21)9-18(17)27-20/h4-10H,1-3H3,(H,22,23)/b16-10+InChIKey
YXEKMTGKYUKBMR-MHWRWJLKSA-NSynonyms
330470-99-0(4E)4(((6chloro13benzothiazol2yl)amino)methylidene)2(34dimethylphenyl)5methyl24dihydro3Hpyrazol3one
(4E)4(((6chloro13benzothiazol2yl)amino)methylidene)2(34dimethylphenyl)5methylpyrazol3one
330470990
CC1=C(C=C(C=C1)N2C(=O)C(=CNC3=NC4=C(S3)C=C(C=C4)Cl)C(=N2)C)C
Clc1ccc2c(c1)sc(n2)NC=C1C(=NN(C1=O)c1ccc(c(c1)C)C)C
InChI=1SC20H17ClN4OSc1114615(812(11)2)2519(26)16(13(3)2425)10222023177514(21)918(17)2720h410H13H3(H2223)b1610+
MFCD28033103
ZINC000101122147
ZINC101122147
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