N-[4-[[2-(furan-2-ylmethylcarbamoyl)phenyl]amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[[2-(furan-2-ylmethylcarbamoyl)phenyl]amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide Openeye Name: N-[4-[2-(2-furylmethylcarbamoyl)anilino]-4-oxo-butyl]adamantane-1-carboxamide CAS Name: N-[4-[2-[(2-furanylmethylamino)-oxomethyl]anilino]-4-oxobutyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[2-(furan-2-ylmethylcarbamoyl)anilino]-4-oxobutyl]adamantane-1-carboxamide Traditional Name: N-[4-[2-(2-furfurylcarbamoyl)anilino]-4-keto-butyl]adamantane-1-carboxamide Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCC(=O)NC4=CC=CC=C4C(=O)NCC5=CC=CO5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCC(=O)NC4=CC=CC=C4C(=O)NCC5=CC=CO5

InChI

InChI=1S/C27H33N3O4/c31-24(30-23-7-2-1-6-22(23)25(32)29-17-21-5-4-10-34-21)8-3-9-28-26(33)27-14-18-11-19(15-27)13-20(12-18)16-27/h1-2,4-7,10,18-20H,3,8-9,11-17H2,(H,28,33)(H,29,32)(H,30,31)