N-[(1S)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-N-phenethyl-furan-2-carboxamide

Systemtic Name: N-[(1S)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-N-phenethyl-furan-2-carboxamide Openeye Name: N-[(1S)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxo-ethyl]-N-phenethyl-furan-2-carboxamide CAS Name: N-[(1S)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxoethyl]-N-phenethyl-2-furancarboxamide IUPAC Name: N-[(1S)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxoethyl]-N-phenethylfuran-2-carboxamide Traditional Name: N-[(1S)-2-(cyclohexylamino)-2-keto-1-(3-methoxyphenyl)ethyl]-N-phenethyl-2-furamide Formula: C28H32N2O4 MolecularWeight: 460.56468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C(=O)NC2CCCCC2)N(CCC3=CC=CC=C3)C(=O)C4=CC=CO4

Isomeric SMILES

COC1=CC=CC(=C1)[C@@H](C(=O)NC2CCCCC2)N(CCC3=CC=CC=C3)C(=O)C4=CC=CO4

InChI

InChI=1S/C28H32N2O4/c1-33-24-15-8-12-22(20-24)26(27(31)29-23-13-6-3-7-14-23)30(28(32)25-16-9-19-34-25)18-17-21-10-4-2-5-11-21/h2,4-5,8-12,15-16,19-20,23,26H,3,6-7,13-14,17-18H2,1H3,(H,29,31)/t26-/m0/s1