Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-5-(4-methoxyphenyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK043534
SMILES COc1ccc(cc1)C1=NN(C(=O)C1)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 C17H13N3O2S MW 323.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N3O2S/c1-22-12-8-6-11(7-9-12)14-10-16(21)20(19-14)17-18-13-4-2-3-5-15(13)23-17/h2-9H,10H2,1H3InChIKey
XTNYJLMDGBTJQY-UHFFFAOYSA-NSynonyms
1(benzo(d)thiazol2yl)3(4methoxyphenyl)1Hpyrazol5(4H)one
2(13BENZOTHIAZOL2YL)5(4METHOXYPHENYL)24DIHYDRO3HPYRAZOL3ONE
2(13BENZOTHIAZOL2YL)5(4METHOXYPHENYL)4HPYRAZOL3ONE
2BENZOTHIAZOL2YL5(4METHOXYPHENYL)24DIHYDROPYRAZOL3ONE
COC1=CC=C(C=C1)C2=NN(C(=O)C2)C3=NC4=CC=CC=C4S3
COc1ccc(cc1)C1=NN(C(=O)C1)c1nc2c(s1)cccc2
InChI=1SC17H13N3O2Sc122128611(7912)141016(21)20(1914)171813423515(13)2317h29H10H21H3
MFCD02375558
STK043534
ZINC000100525327
ZINC100525327
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