Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-5-(3-methoxyphenyl)-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK604815
SMILES COc1cccc(c1)c1[nH]n(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/c1-22-12-6-4-5-11(9-12)14-10-16(21)20(19-14)17-18-13-7-2-3-8-15(13)23-17/h2-10,19H,1H3InChIKey
JREPFEBWKHMIQO-UHFFFAOYSA-NSynonyms
944788-29-81BENZOTHIAZOL2YL3(3METHOXYPHENYL)PYRAZOL5OL
2(13benzothiazol2yl)5(3methoxyphenyl)12dihydro3Hpyrazol3one
2(13benzothiazol2yl)5(3methoxyphenyl)1Hpyrazol3one
944788298
COC1=CC=CC(=C1)C2=CC(=O)N(N2)C3=NC4=CC=CC=C4S3
COc1cccc(c1)c1(nH)n(c(=O)c1)c1nc2c(s1)cccc2
InChI=1SC17H13N3O2Sc1221264511(912)141016(21)20(1914)171813723815(13)2317h21019H1H3
MFCD08736993
ZINC000009227012
ZINC09227012
ZINC100134584
ZINC9227012
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