3-(1-adamantyl)-1-cyclopropyl-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea

Systemtic Name: 3-(1-adamantyl)-1-cyclopropyl-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea Openeye Name: 3-(1-adamantyl)-1-[(1-benzylpyrrol-2-yl)methyl]-1-cyclopropyl-urea CAS Name: 3-(1-adamantyl)-1-cyclopropyl-1-[[1-(phenylmethyl)-2-pyrrolyl]methyl]urea IUPAC Name: 3-(1-adamantyl)-1-[(1-benzylpyrrol-2-yl)methyl]-1-cyclopropylurea Traditional Name: 3-(1-adamantyl)-1-[(1-benzylpyrrol-2-yl)methyl]-1-cyclopropyl-urea Formula: C26H33N3O MolecularWeight: 403.55972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=CN2CC3=CC=CC=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CC1N(CC2=CC=CN2CC3=CC=CC=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H33N3O/c30-25(27-26-14-20-11-21(15-26)13-22(12-20)16-26)29(23-8-9-23)18-24-7-4-10-28(24)17-19-5-2-1-3-6-19/h1-7,10,20-23H,8-9,11-18H2,(H,27,30)