N-[1-(furan-2-ylmethylsulfinyl)-2-oxidanylidene-heptan-3-yl]-4-methyl-2-(2-phenoxyethanoylamino)pentanamide

Systemtic Name: N-[1-(furan-2-ylmethylsulfinyl)-2-oxidanylidene-heptan-3-yl]-4-methyl-2-(2-phenoxyethanoylamino)pentanamide Openeye Name: N-[1-[2-(2-furylmethylsulfinyl)acetyl]pentyl]-4-methyl-2-[(2-phenoxyacetyl)amino]pentanamide CAS Name: N-[1-(2-furanylmethylsulfinyl)-2-oxoheptan-3-yl]-4-methyl-2-[(1-oxo-2-phenoxyethyl)amino]pentanamide IUPAC Name: N-[1-(furan-2-ylmethylsulfinyl)-2-oxoheptan-3-yl]-4-methyl-2-[(2-phenoxyacetyl)amino]pentanamide Traditional Name: N-[1-[2-(2-furfurylsulfinyl)acetyl]pentyl]-4-methyl-2-[(2-phenoxyacetyl)amino]valeramide Formula: C26H36N2O6S MolecularWeight: 504.63884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)CS(=O)CC1=CC=CO1)NC(=O)C(CC(C)C)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CCCCC(C(=O)CS(=O)CC1=CC=CO1)NC(=O)C(CC(C)C)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C26H36N2O6S/c1-4-5-13-22(24(29)18-35(32)17-21-12-9-14-33-21)28-26(31)23(15-19(2)3)27-25(30)16-34-20-10-7-6-8-11-20/h6-12,14,19,22-23H,4-5,13,15-18H2,1-3H3,(H,27,30)(H,28,31)