Vitas-M small molecule compound

2-[(2Z)-1,3-benzothiazol-2(3H)-ylideneamino]-4-(4-methoxyphenyl)-6-methylpyrimidine-5-carbonitrile

Catalog ID
STK848290
SMILES COc1ccc(cc1)c1nc(/N=c/2\sc3c([nH]2)cccc3)nc(c1C#N)C

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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 C20H15N5OS MW 373.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N5OS/c1-12-15(11-21)18(13-7-9-14(26-2)10-8-13)24-19(22-12)25-20-23-16-5-3-4-6-17(16)27-20/h3-10H,1-2H3,(H,22,23,24,25)
InChIKey
KPODCECKSVSFGB-UHFFFAOYSA-N
Synonyms
371125-60-9
2((2Z)13benzothiazol2(3H)ylideneamino)4(4methoxyphenyl)6methylpyrimidine5carbonitrile
371125609
COc1ccc(cc1)c1nc(N=c2sc3c((nH)2)cccc3)nc(c1C#N)C
MFCD07210831
ZINC000009015935

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Available files

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