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

Systemtic Name: N-[(1S)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-N-(phenylmethyl)furan-2-carboxamide Openeye Name: N-benzyl-N-[(1S)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[(1S)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxoethyl]-N-(phenylmethyl)-2-furancarboxamide IUPAC Name: N-benzyl-N-[(1S)-2-(cyclohexylamino)-1-(3-methoxyphenyl)-2-oxoethyl]furan-2-carboxamide Traditional Name: N-benzyl-N-[(1S)-2-(cyclohexylamino)-2-keto-1-(3-methoxyphenyl)ethyl]-2-furamide Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C(=O)NC2CCCCC2)N(CC3=CC=CC=C3)C(=O)C4=CC=CO4

Isomeric SMILES

COC1=CC=CC(=C1)[C@@H](C(=O)NC2CCCCC2)N(CC3=CC=CC=C3)C(=O)C4=CC=CO4

InChI

InChI=1S/C27H30N2O4/c1-32-23-15-8-12-21(18-23)25(26(30)28-22-13-6-3-7-14-22)29(19-20-10-4-2-5-11-20)27(31)24-16-9-17-33-24/h2,4-5,8-12,15-18,22,25H,3,6-7,13-14,19H2,1H3,(H,28,30)/t25-/m0/s1