Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-4-{1-[(2,5-dimethoxyphenyl)amino]ethylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK143153
SMILES COc1ccc(c(c1)N/C(=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)C)/C)OC
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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 C21H20N4O3S MW 408.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S/c1-12(22-16-11-14(27-3)9-10-17(16)28-4)19-13(2)24-25(20(19)26)21-23-15-7-5-6-8-18(15)29-21/h5-11,22H,1-4H3/b19-12-InChIKey
OWCPGLNSDHRKPC-UNOMPAQXSA-NSynonyms
(4Z)2(13BENZOTHIAZOL2YL)4(1((25DIMETHOXYPHENYL)AMINO)ETHYLIDENE)5METHYL24DIHYDRO3HPYRAZOL3ONE
(4Z)2(13BENZOTHIAZOL2YL)4(1(25DIMETHOXYANILINO)ETHYLIDENE)5METHYLPYRAZOL3ONE
(Z)1(benzo(d)thiazol2yl)4(1((25dimethoxyphenyl)amino)ethylidene)3methyl1Hpyrazol5(4H)one
1(13BENZOTHIAZOL2YL)4((1E)N(25DIMETHOXYPHENYL)ETHANIMIDOYL)3METHYL1HPYRAZOL5OL
1BENZOTHIAZOL2YL4(((25DIMETHOXYPHENYL)AMINO)ETHYLIDENE)3METHYL12DIAZOLIN5ONE
CC1=NN(C(=O)C1=C(C)NC2=C(C=CC(=C2)OC)OC)C3=NC4=CC=CC=C4S3
COc1ccc(c(c1)NC(=C1C(=NN(C1=O)c1nc2c(s1)cccc2)C)C)OC
InChI=1SC21H20N4O3Sc112(22161114(273)91017(16)284)1913(2)2425(20(19)26)212315756818(15)2921h51122H14H3b1912
MFCD03163288
ZINC000100422701
ZINC100422701
Check stock
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Check stock on Vitas-MAvailable files
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