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

Systemtic Name: 3-(1-adamantyl)-1-(2-methoxyethyl)-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea Openeye Name: 3-(1-adamantyl)-1-[(1-benzylpyrrol-2-yl)methyl]-1-(2-methoxyethyl)urea CAS Name: 3-(1-adamantyl)-1-(2-methoxyethyl)-1-[[1-(phenylmethyl)-2-pyrrolyl]methyl]urea IUPAC Name: 3-(1-adamantyl)-1-[(1-benzylpyrrol-2-yl)methyl]-1-(2-methoxyethyl)urea Traditional Name: 3-(1-adamantyl)-1-[(1-benzylpyrrol-2-yl)methyl]-1-(2-methoxyethyl)urea Formula: C26H35N3O2 MolecularWeight: 421.575

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=CN1CC2=CC=CC=C2)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COCCN(CC1=CC=CN1CC2=CC=CC=C2)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H35N3O2/c1-31-11-10-29(19-24-8-5-9-28(24)18-20-6-3-2-4-7-20)25(30)27-26-15-21-12-22(16-26)14-23(13-21)17-26/h2-9,21-23H,10-19H2,1H3,(H,27,30)