Vitas-M small molecule compound
2-(1,3-benzothiazol-2-yl)-4-[(E)-(nonylimino)methyl]-5-phenyl-1,2-dihydro-3H-pyrazol-3-one
Catalog ID
STK956991
SMILES CCCCCCCCC/N=C/c1c([nH]n(c1=O)c1nc2c(s1)cccc2)c1ccccc1
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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 C26H30N4OS MW 446.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4OS/c1-2-3-4-5-6-7-13-18-27-19-21-24(20-14-9-8-10-15-20)29-30(25(21)31)26-28-22-16-11-12-17-23(22)32-26/h8-12,14-17,19,29H,2-7,13,18H2,1H3/b27-19+InChIKey
QTYNXWDCVBVOKC-ZXVVBBHZSA-NSynonyms
354542-82-82(13benzothiazol2yl)4((E)(nonylimino)methyl)5phenyl12dihydro3Hpyrazol3one
354542828
CCCCCCCCCN=Cc1c((nH)n(c1=O)c1nc2c(s1)cccc2)c1ccccc1
MFCD01417537
ZINC000002092100
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