Vitas-M small molecule compound

1,3-benzothiazol-6-yl[4-(4-methoxyphenyl)piperazin-1-yl]methanone

Catalog ID
STK718076
SMILES COc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc2c(c1)scn2

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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 C19H19N3O2S MW 353.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O2S/c1-24-16-5-3-15(4-6-16)21-8-10-22(11-9-21)19(23)14-2-7-17-18(12-14)25-13-20-17/h2-7,12-13H,8-11H2,1H3
InChIKey
VGUDSMZJKITMOY-UHFFFAOYSA-N
Synonyms
790701-20-1
13benzothiazol6yl(4(4methoxyphenyl)piperazin1yl)methanone
790701201
benzo(d)thiazol6yl(4(4methoxyphenyl)piperazin1yl)methanone
COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)N=CS4
InChI=1SC19H19N3O2Sc124165315(4616)2181022(11921)19(23)14271718(1214)25132017h271213H811H21H3
MFCD06358888
ZINC000003400582
ZINC03400582
ZINC3400582

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Available files

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