1-(1-adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea

Systemtic Name: 1-(1-adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea Openeye Name: 1-(1-adamantyl)-3-[(4-isopropylphenyl)methyl]urea CAS Name: 1-(1-adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea IUPAC Name: 1-(1-adamantyl)-3-[(4-propan-2-ylphenyl)methyl]urea Traditional Name: 1-(1-adamantyl)-3-(4-isopropylbenzyl)urea Formula: C21H30N2O MolecularWeight: 326.4757

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H30N2O/c1-14(2)19-5-3-15(4-6-19)13-22-20(24)23-21-10-16-7-17(11-21)9-18(8-16)12-21/h3-6,14,16-18H,7-13H2,1-2H3,(H2,22,23,24)