N-(3-ethoxypropyl)-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-(3-ethoxypropyl)-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-(3-ethoxypropyl)adamantane-1-carboxamide CAS Name: N-(3-ethoxypropyl)-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-(3-ethoxypropyl)adamantane-1-carboxamide Traditional Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-(3-ethoxypropyl)adamantane-1-carboxamide Formula: C31H43N3O3 MolecularWeight: 505.69142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H43N3O3/c1-3-37-14-8-13-33(30(36)31-18-25-15-26(19-31)17-27(16-25)20-31)23-29(35)34(21-24-9-5-4-6-10-24)22-28-11-7-12-32(28)2/h4-7,9-12,25-27H,3,8,13-23H2,1-2H3