Vitas-M small molecule compound

1-(3-methoxypropyl)-3-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-pyrazol-3-yl]thiourea

Catalog ID
STK303146
SMILES COCCCNC(=S)Nc1ccn(n1)C12CC3CC(C2)CC(C1)C3

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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 C18H28N4OS MW 348.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H28N4OS/c1-23-6-2-4-19-17(24)20-16-3-5-22(21-16)18-10-13-7-14(11-18)9-15(8-13)12-18/h3,5,13-15H,2,4,6-12H2,1H3,(H2,19,20,21,24)
InChIKey
XWICQXJFMJWBOM-UHFFFAOYSA-N
Synonyms
895066-52-1
1(1(1ADAMANTYL)PYRAZOL3YL)3(3METHOXYPROPYL)THIOUREA
1(3methoxypropyl)3(1(tricyclo(3311~37~)dec1yl)1Hpyrazol3yl)thiourea
895066521
COCCCNC(=S)NC1=NN(C=C1)C23CC4CC(C2)CC(C4)C3
InChI=1SC18H28N4OSc1236241917(24)20163522(2116)181013714(1118)915(813)1218h351315H24612H21H3(H219202124)
MFCD04129116
ZINC000006640763
ZINC06640763
ZINC6640763

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Available files

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