Vitas-M small molecule compound

1-(3'-cyano-1'H-spiro[cyclopentane-1,2'-naphthalen]-4'-yl)-3-(2-methoxyphenyl)urea

Catalog ID
STK642020
SMILES COc1ccccc1NC(=O)NC1=C(C#N)C2(Cc3c1cccc3)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 C23H23N3O2 MW 373.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O2/c1-28-20-11-5-4-10-19(20)25-22(27)26-21-17-9-3-2-8-16(17)14-23(18(21)15-24)12-6-7-13-23/h2-5,8-11H,6-7,12-14H2,1H3,(H2,25,26,27)
InChIKey
DNVVFPNHBWKKGV-UHFFFAOYSA-N
Synonyms
898613-01-9
1(2cyanospiro(4Hnaphthalene31cyclopentane)1yl)3(2methoxyphenyl)urea
1(3cyano1Hspiro(cyclopentane12naphthalen)4yl)3(2methoxyphenyl)urea
898613019
COC1=CC=CC=C1NC(=O)NC2=C(C3(CCCC3)CC4=CC=CC=C42)C#N
InChI=1SC23H23N3O2c1282011541019(20)2522(27)262117932816(17)1423(18(21)1524)12671323h25811H671214H21H3(H2252627)
MFCD12210303
ZINC000020745441
ZINC20745441

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Available files

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