Vitas-M small molecule compound
1-(3'-cyano-1'H-spiro[cyclohexane-1,2'-naphthalen]-4'-yl)-3-methylurea
Catalog ID
STK636806
SMILES CNC(=O)NC1=C(C#N)C2(Cc3c1cccc3)CCCCC2
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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 C18H21N3O MW 295.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N3O/c1-20-17(22)21-16-14-8-4-3-7-13(14)11-18(15(16)12-19)9-5-2-6-10-18/h3-4,7-8H,2,5-6,9-11H2,1H3,(H2,20,21,22)InChIKey
PEBNCZNMPFXRAB-UHFFFAOYSA-NSynonyms
898614-05-61(2cyanospiro(4Hnaphthalene31cyclohexane)1yl)3methylurea
1(3cyano1Hspiro(cyclohexane12naphthalen)4yl)3methylurea
898614056
CNC(=O)NC1=C(C2(CCCCC2)CC3=CC=CC=C31)C#N
InChI=1SC18H21N3Oc12017(22)211614843713(14)1118(15(16)1219)95261018h3478H256911H21H3(H2202122)
MFCD12209311
ZINC000020738461
ZINC20738461
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