Vitas-M small molecule compound

3-[3-(3-methylphenoxy)propyl]-1,3-benzothiazol-2(3H)-one

Catalog ID
STK865975
SMILES Cc1cccc(c1)OCCCn1c(=O)sc2c1cccc2

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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 C17H17NO2S MW 299.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17NO2S/c1-13-6-4-7-14(12-13)20-11-5-10-18-15-8-2-3-9-16(15)21-17(18)19/h2-4,6-9,12H,5,10-11H2,1H3
InChIKey
KJLZFSBURVDWKP-UHFFFAOYSA-N
Synonyms
842956-92-7
3(3(3methylphenoxy)propyl)13benzothiazol2(3H)one
3(3(3METHYLPHENOXY)PROPYL)13BENZOTHIAZOL2ONE
3(3(MTOLYLOXY)PROPYL)BENZO(D)THIAZOL2(3H)ONE
3(3MTOLYLOXYPROPYL)3HBENZOTHIAZOL2ONE
842956927
CC1=CC(=CC=C1)OCCCN2C3=CC=CC=C3SC2=O
InChI=1SC17H17NO2Sc11364714(1213)20115101815823916(15)2117(18)19h246912H51011H21H3
MFCD05668344
ZINC000004503894
ZINC04503894
ZINC4503894

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Available files

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