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

Systemtic Name: N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-N-(2-methylpropyl)adamantane-1-carboxamide Openeye Name: N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-N-isobutyl-adamantane-1-carboxamide CAS Name: N-[2-[butyl-[(1-methyl-2-pyrrolyl)methyl]amino]-2-oxoethyl]-N-(2-methylpropyl)-1-adamantanecarboxamide IUPAC Name: N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-(2-methylpropyl)adamantane-1-carboxamide Traditional Name: N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-isobutyl-adamantane-1-carboxamide Formula: C27H43N3O2 MolecularWeight: 441.64922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1C)C(=O)CN(CC(C)C)C(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCCN(CC1=CC=CN1C)C(=O)CN(CC(C)C)C(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C27H43N3O2/c1-5-6-10-29(18-24-8-7-9-28(24)4)25(31)19-30(17-20(2)3)26(32)27-14-21-11-22(15-27)13-23(12-21)16-27/h7-9,20-23H,5-6,10-19H2,1-4H3