N-[4-[furan-2-ylmethyl-(2-oxidanylidene-2-phenylazanyl-ethyl)amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[furan-2-ylmethyl-(2-oxidanylidene-2-phenylazanyl-ethyl)amino]-4-oxidanylidene-butyl]adamantane-1-carboxamide Openeye Name: N-[4-[(2-anilino-2-oxo-ethyl)-(2-furylmethyl)amino]-4-oxo-butyl]adamantane-1-carboxamide CAS Name: N-[4-[(2-anilino-2-oxoethyl)-(2-furanylmethyl)amino]-4-oxobutyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[(2-anilino-2-oxoethyl)-(furan-2-ylmethyl)amino]-4-oxobutyl]adamantane-1-carboxamide Traditional Name: N-[4-[(2-anilino-2-keto-ethyl)-(2-furfuryl)amino]-4-keto-butyl]adamantane-1-carboxamide Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCC(=O)N(CC4=CC=CO4)CC(=O)NC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCC(=O)N(CC4=CC=CO4)CC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C28H35N3O4/c32-25(30-23-6-2-1-3-7-23)19-31(18-24-8-5-11-35-24)26(33)9-4-10-29-27(34)28-15-20-12-21(16-28)14-22(13-20)17-28/h1-3,5-8,11,20-22H,4,9-10,12-19H2,(H,29,34)(H,30,32)