Vitas-M small molecule compound

1-(2-cyano-3,3-diethyl-3,4-dihydronaphthalen-1-yl)-3-(3-methoxyphenyl)urea

Catalog ID
STK788022
SMILES N#CC1=C(NC(=O)Nc2cccc(c2)OC)c2ccccc2CC1(CC)CC

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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 C23H25N3O2 MW 375.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O2/c1-4-23(5-2)14-16-9-6-7-12-19(16)21(20(23)15-24)26-22(27)25-17-10-8-11-18(13-17)28-3/h6-13H,4-5,14H2,1-3H3,(H2,25,26,27)
InChIKey
ZSUORJGCYDJQGI-UHFFFAOYSA-N
Synonyms

1(2cyano33diethyl34dihydronaphthalen1yl)3(3methoxyphenyl)urea
1(2cyano33diethyl4Hnaphthalen1yl)3(3methoxyphenyl)urea
CCC1(CC2=CC=CC=C2C(=C1C#N)NC(=O)NC3=CC(=CC=C3)OC)CC
InChI=1SC23H25N3O2c1423(52)14169671219(16)21(20(23)1524)2622(27)25171081118(1317)283h613H4514H213H3(H2252627)
MFCD12035030
ZINC000015841459
ZINC15841459

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Available files

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