N-(2-methylpropyl)-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-(2-methylpropyl)-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-N-isobutyl-adamantane-1-carboxamide CAS Name: N-(2-methylpropyl)-N-[2-[(1-methyl-2-pyrrolyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-(2-methylpropyl)adamantane-1-carboxamide Traditional Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-isobutyl-adamantane-1-carboxamide Formula: C30H41N3O2 MolecularWeight: 475.66544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)CN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C30H41N3O2/c1-22(2)18-33(29(35)30-15-24-12-25(16-30)14-26(13-24)17-30)21-28(34)32(19-23-8-5-4-6-9-23)20-27-10-7-11-31(27)3/h4-11,22,24-26H,12-21H2,1-3H3