N-[4-(furan-2-ylmethylsulfanyl)-3-oxidanylidene-1-phenyl-butan-2-yl]-4-methyl-2-(2-phenoxyethanoylamino)pentanamide

Systemtic Name: N-[4-(furan-2-ylmethylsulfanyl)-3-oxidanylidene-1-phenyl-butan-2-yl]-4-methyl-2-(2-phenoxyethanoylamino)pentanamide Openeye Name: N-[1-benzyl-3-(2-furylmethylsulfanyl)-2-oxo-propyl]-4-methyl-2-[(2-phenoxyacetyl)amino]pentanamide CAS Name: N-[4-(2-furanylmethylthio)-3-oxo-1-phenylbutan-2-yl]-4-methyl-2-[(1-oxo-2-phenoxyethyl)amino]pentanamide IUPAC Name: N-[4-(furan-2-ylmethylsulfanyl)-3-oxo-1-phenylbutan-2-yl]-4-methyl-2-[(2-phenoxyacetyl)amino]pentanamide Traditional Name: N-[1-benzyl-3-(2-furfurylthio)-2-keto-propyl]-4-methyl-2-[(2-phenoxyacetyl)amino]valeramide Formula: C29H34N2O5S MolecularWeight: 522.65566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)CSCC2=CC=CO2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)CSCC2=CC=CO2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C29H34N2O5S/c1-21(2)16-26(30-28(33)18-36-23-12-7-4-8-13-23)29(34)31-25(17-22-10-5-3-6-11-22)27(32)20-37-19-24-14-9-15-35-24/h3-15,21,25-26H,16-20H2,1-2H3,(H,30,33)(H,31,34)