Vitas-M small molecule compound

4-(3-oxo-1,2-benzothiazol-2(3H)-yl)-N-(pyridin-2-yl)butanamide

Catalog ID
STK936731
SMILES O=C(Nc1ccccn1)CCCn1sc2c(c1=O)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 C16H15N3O2S MW 313.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O2S/c20-15(18-14-8-3-4-10-17-14)9-5-11-19-16(21)12-6-1-2-7-13(12)22-19/h1-4,6-8,10H,5,9,11H2,(H,17,18,20)
InChIKey
AIQTYUKNOPZHSK-UHFFFAOYSA-N
Synonyms
1190240-09-5
1190240095
4(3oxo12benzothiazol2(3H)yl)N(pyridin2yl)butanamide
4(3oxo12benzothiazol2yl)Npyridin2ylbutanamide
4(3oxobenzo(d)isothiazol2(3H)yl)N(pyridin2yl)butanamide
C1=CC=C2C(=C1)C(=O)N(S2)CCCC(=O)NC3=CC=CC=N3
InChI=1SC16H15N3O2Sc2015(1814834101714)95111916(21)12612713(12)2219h146810H5911H2(H171820)
MFCD13755492
ZINC000036352670
ZINC36352670

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Available files

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