1-(1-adamantyl)-3-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]urea

Systemtic Name: 1-(1-adamantyl)-3-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]urea Openeye Name: 1-(1-adamantyl)-3-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]urea CAS Name: 1-(1-adamantyl)-3-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]urea IUPAC Name: 1-(1-adamantyl)-3-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]urea Traditional Name: 1-(1-adamantyl)-3-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]urea Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NN2)NC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NN2)NC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H26N4O2/c1-27-17-4-2-16(3-5-17)18-9-19(25-24-18)22-20(26)23-21-10-13-6-14(11-21)8-15(7-13)12-21/h2-5,9,13-15H,6-8,10-12H2,1H3,(H3,22,23,24,25,26)