Vitas-M small molecule compound

1,3-benzothiazol-2-yl[1-(2,5-dimethylphenyl)-2,6-dimethylpyridin-4(1H)-ylidene]acetonitrile

Catalog ID
STL073151
SMILES N#C/C(=c/1\cc(C)n(c(c1)C)c1cc(C)ccc1C)/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 C24H21N3S MW 383.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3S/c1-15-9-10-16(2)22(11-15)27-17(3)12-19(13-18(27)4)20(14-25)24-26-21-7-5-6-8-23(21)28-24/h5-13H,1-4H3
InChIKey
JOVYTHQESCGCIB-UHFFFAOYSA-N
Synonyms

13benzothiazol2yl(1(25dimethylphenyl)26dimethylpyridin4(1H)ylidene)acetonitrile
2(13BENZOTHIAZOL2YL)2(1(25DIMETHYLPHENYL)26DIMETHYLPYRIDIN4YLIDENE)ACETONITRILE
2BENZOTHIAZOL2YL2(1(25DIMETHYLPHENYL)26DIMETHYL(4HYDROPYRIDYLIDENE))ETHANENITRILE
CC1=CC(=C(C=C1)C)N2C(=CC(=C(C#N)C3=NC4=CC=CC=C4S3)C=C2C)C
InChI=1SC24H21N3Sc11591016(2)22(1115)2717(3)1219(1318(27)4)20(1425)242621756823(21)2824h513H14H3
MFCD02694993
N#CC(=c1cc(C)n(c(c1)C)c1cc(C)ccc1C)c1nc2c(s1)cccc2
ZINC000003191005
ZINC03191005
ZINC3191005

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Available files

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