N-[4-[butyl(furan-2-ylmethyl)amino]-3-pyrrolidin-1-ylcarbonyl-phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[butyl(furan-2-ylmethyl)amino]-3-pyrrolidin-1-ylcarbonyl-phenyl]adamantane-1-carboxamide Openeye Name: N-[4-[butyl(2-furylmethyl)amino]-3-(pyrrolidine-1-carbonyl)phenyl]adamantane-1-carboxamide CAS Name: N-[4-[butyl(2-furanylmethyl)amino]-3-[oxo(1-pyrrolidinyl)methyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[butyl(furan-2-ylmethyl)amino]-3-(pyrrolidine-1-carbonyl)phenyl]adamantane-1-carboxamide Traditional Name: N-[4-[butyl(2-furfuryl)amino]-3-(pyrrolidine-1-carbonyl)phenyl]adamantane-1-carboxamide Formula: C31H41N3O3 MolecularWeight: 503.67554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CO1)C2=C(C=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)C(=O)N6CCCC6

Isomeric SMILES

CCCCN(CC1=CC=CO1)C2=C(C=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)C(=O)N6CCCC6

InChI

InChI=1S/C31H41N3O3/c1-2-3-10-34(21-26-7-6-13-37-26)28-9-8-25(17-27(28)29(35)33-11-4-5-12-33)32-30(36)31-18-22-14-23(19-31)16-24(15-22)20-31/h6-9,13,17,22-24H,2-5,10-12,14-16,18-21H2,1H3,(H,32,36)