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

Systemtic Name: N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-N-propyl-adamantane-1-carboxamide Openeye Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-N-propyl-adamantane-1-carboxamide CAS Name: N-[2-[(1-methyl-2-pyrrolyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-N-propyl-1-adamantanecarboxamide IUPAC Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-propyladamantane-1-carboxamide Traditional Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-propyl-adamantane-1-carboxamide Formula: C29H39N3O2 MolecularWeight: 461.63886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H39N3O2/c1-3-11-31(28(34)29-16-23-13-24(17-29)15-25(14-23)18-29)21-27(33)32(19-22-8-5-4-6-9-22)20-26-10-7-12-30(26)2/h4-10,12,23-25H,3,11,13-21H2,1-2H3