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

Systemtic Name: 3-(1-adamantyl)-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]-1-propan-2-yl-urea Openeye Name: 3-(1-adamantyl)-1-[(1-benzylpyrrol-2-yl)methyl]-1-isopropyl-urea CAS Name: 3-(1-adamantyl)-1-[[1-(phenylmethyl)-2-pyrrolyl]methyl]-1-propan-2-ylurea IUPAC Name: 3-(1-adamantyl)-1-[(1-benzylpyrrol-2-yl)methyl]-1-propan-2-ylurea Traditional Name: 3-(1-adamantyl)-1-[(1-benzylpyrrol-2-yl)methyl]-1-isopropyl-urea Formula: C26H35N3O MolecularWeight: 405.5756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H35N3O/c1-19(2)29(18-24-9-6-10-28(24)17-20-7-4-3-5-8-20)25(30)27-26-14-21-11-22(15-26)13-23(12-21)16-26/h3-10,19,21-23H,11-18H2,1-2H3,(H,27,30)