Vitas-M small molecule compound
1-(5,6,7,8-tetrahydronaphthalen-1-yl)-3-tricyclo[3.3.1.1~3,7~]dec-1-ylurea
Catalog ID
STK430974
SMILES O=C(NC12CC3CC(C2)CC(C1)C3)Nc1cccc2c1CCCC2
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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 C21H28N2O MW 324.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O/c24-20(22-19-7-3-5-17-4-1-2-6-18(17)19)23-21-11-14-8-15(12-21)10-16(9-14)13-21/h3,5,7,14-16H,1-2,4,6,8-13H2,(H2,22,23,24)InChIKey
JULANUGYJPEDGS-UHFFFAOYSA-NSynonyms
1(1adamantyl)3(5678tetrahydronaphthalen1yl)urea
1(5678tetrahydronaphthalen1yl)3tricyclo(3311~37~)dec1ylurea
C1CCC2=C(C1)C=CC=C2NC(=O)NC34CC5CC(C3)CC(C5)C4
InChI=1SC21H28N2Oc2420(221973517412618(17)19)23211114815(1221)1016(914)1321h3571416H1246813H2(H2222324)
MFCD03074397
ZINC000005897113
ZINC05897113
ZINC5897113
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