Vitas-M small molecule compound

1-(1,3-benzothiazol-2-yl)-6-(furan-2-yl)-1,5,6,7-tetrahydro-4H-indazol-4-one

Catalog ID
STK217507
SMILES O=C1CC(Cc2c1cnn2c1nc2c(s1)cccc2)c1ccco1

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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 C18H13N3O2S MW 335.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N3O2S/c22-15-9-11(16-5-3-7-23-16)8-14-12(15)10-19-21(14)18-20-13-4-1-2-6-17(13)24-18/h1-7,10-11H,8-9H2
InChIKey
LYPVRPORVCNRQW-UHFFFAOYSA-N
Synonyms
774561-04-5
1(13benzothiazol2yl)6(furan2yl)1567tetrahydro4Hindazol4one
1(13BENZOTHIAZOL2YL)6(FURAN2YL)67DIHYDRO5HINDAZOL4ONE
1(benzo(d)thiazol2yl)6(furan2yl)67dihydro1Hindazol4(5H)one
774561045
C1C(CC(=O)C2=C1N(N=C2)C3=NC4=CC=CC=C4S3)C5=CC=CO5
InChI=1SC18H13N3O2Sc2215911(165372316)81412(15)101921(14)182013412617(13)2418h171011H89H2
MFCD06607630
ZINC000002334499
ZINC000002334500

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.