1-(1-adamantyl)-3-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]urea Openeye Name: 1-(1-adamantyl)-3-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]urea CAS Name: 1-(1-adamantyl)-3-[4-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]phenyl]urea IUPAC Name: 1-(1-adamantyl)-3-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]urea Traditional Name: 1-(1-adamantyl)-3-[4-[4-(4-tert-butylbenzoyl)piperazino]phenyl]urea Formula: C32H42N4O2 MolecularWeight: 514.70148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C32H42N4O2/c1-31(2,3)26-6-4-25(5-7-26)29(37)36-14-12-35(13-15-36)28-10-8-27(9-11-28)33-30(38)34-32-19-22-16-23(20-32)18-24(17-22)21-32/h4-11,22-24H,12-21H2,1-3H3,(H2,33,34,38)