Vitas-M small molecule compound

3-(1,3-benzothiazol-2-yl)-5,7-dimethyl-4H-chromen-4-one

Catalog ID
STK552727
SMILES Cc1cc(C)c2c(c1)occ(c2=O)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 C18H13NO2S MW 307.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13NO2S/c1-10-7-11(2)16-14(8-10)21-9-12(17(16)20)18-19-13-5-3-4-6-15(13)22-18/h3-9H,1-2H3
InChIKey
FCFIAMSPYVJDTI-UHFFFAOYSA-N
Synonyms
610760-36-6
3(13benzothiazol2yl)57dimethyl4Hchromen4one
3(13BENZOTHIAZOL2YL)57DIMETHYLCHROMEN4ONE
3(BENZO(D)THIAZOL2YL)57DIMETHYL4HCHROMEN4ONE
3BENZOTHIAZOL2YL57DIMETHYLCHROMEN4ONE
610760366
CC1=CC(=C2C(=C1)OC=C(C2=O)C3=NC4=CC=CC=C4S3)C
InChI=1SC18H13NO2Sc110711(2)1614(810)21912(17(16)20)181913534615(13)2218h39H12H3
MFCD03672238
ZINC000001463824
ZINC01463824
ZINC1463824

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Available files

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