1-(1-adamantyl)-3-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]urea

Systemtic Name: 1-(1-adamantyl)-3-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]urea Openeye Name: 1-(1-adamantyl)-3-[3,5-dimethyl-1-(o-tolylmethyl)pyrazol-4-yl]urea CAS Name: 1-(1-adamantyl)-3-[3,5-dimethyl-1-[(2-methylphenyl)methyl]-4-pyrazolyl]urea IUPAC Name: 1-(1-adamantyl)-3-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]urea Traditional Name: 1-(1-adamantyl)-3-[3,5-dimethyl-1-(2-methylbenzyl)pyrazol-4-yl]urea Formula: C24H32N4O MolecularWeight: 392.53708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)NC34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)NC34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C24H32N4O/c1-15-6-4-5-7-21(15)14-28-17(3)22(16(2)27-28)25-23(29)26-24-11-18-8-19(12-24)10-20(9-18)13-24/h4-7,18-20H,8-14H2,1-3H3,(H2,25,26,29)