Vitas-M small molecule compound
1-{2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-3-tricyclo[3.3.1.1~3,7~]dec-1-ylurea
Catalog ID
STL090087
SMILES O=C(NC12CC3CC(C2)CC(C1)C3)NCCN1CCN(CC1)c1ncccn1
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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 C21H32N6O MW 384.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H32N6O/c28-20(25-21-13-16-10-17(14-21)12-18(11-16)15-21)24-4-5-26-6-8-27(9-7-26)19-22-2-1-3-23-19/h1-3,16-18H,4-15H2,(H2,24,25,28)InChIKey
FFAYIKMJZHQVBI-UHFFFAOYSA-NSynonyms
1(1adamantyl)3(2(4pyrimidin2ylpiperazin1yl)ethyl)urea
1(2(4(pyrimidin2yl)piperazin1yl)ethyl)3tricyclo(3311~37~)dec1ylurea
1ADAMANTAN1YL3(2(4PYRIMIDIN2YLPIPERAZIN1YL)ETHYL)UREA
C1CN(CCN1CCNC(=O)NC23CC4CC(C2)CC(C4)C3)C5=NC=CC=N5
InChI=1SC21H32N6Oc2820(252113161017(1421)1218(1116)1521)2445266827(9726)19222132319h131618H415H2(H2242528)
MFCD18204431
ZINC000013802816
ZINC13802816
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