Vitas-M small molecule compound

1,3-benzothiazol-2-yl(1-phenylpyridin-4(1H)-ylidene)acetonitrile

Catalog ID
STL073166
SMILES N#C/C(=c/1\ccn(cc1)c1ccccc1)/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 C20H13N3S MW 327.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N3S/c21-14-17(20-22-18-8-4-5-9-19(18)24-20)15-10-12-23(13-11-15)16-6-2-1-3-7-16/h1-13H
InChIKey
JPALGUIPKYJNAC-UHFFFAOYSA-N
Synonyms

13benzothiazol2yl(1phenylpyridin4(1H)ylidene)acetonitrile
2(13benzothiazol2yl)2(1phenylpyridin4ylidene)acetonitrile
C1=CC=C(C=C1)N2C=CC(=C(C#N)C3=NC4=CC=CC=C4S3)C=C2
InChI=1SC20H13N3Sc211417(202218845919(18)2420)15101223(131115)166213716h113H
MFCD18194748
N#CC(=c1ccn(cc1)c1ccccc1)c1nc2c(s1)cccc2
ZINC000057478238
ZINC57478238

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Available files

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