N-(4-acetamidophenyl)-2-[3-(2-phenoxyethanoylamino)phenyl]sulfanyl-butanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[3-(2-phenoxyethanoylamino)phenyl]sulfanyl-butanamide Openeye Name: N-(4-acetamidophenyl)-2-[3-[(2-phenoxyacetyl)amino]phenyl]sulfanyl-butanamide CAS Name: N-(4-acetamidophenyl)-2-[[3-[(1-oxo-2-phenoxyethyl)amino]phenyl]thio]butanamide IUPAC Name: N-(4-acetamidophenyl)-2-[3-[(2-phenoxyacetyl)amino]phenyl]sulfanylbutanamide Traditional Name: N-(4-acetamidophenyl)-2-[[3-[(2-phenoxyacetyl)amino]phenyl]thio]butyramide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=CC=CC(=C2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=CC=CC(=C2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O4S/c1-3-24(26(32)29-20-14-12-19(13-15-20)27-18(2)30)34-23-11-7-8-21(16-23)28-25(31)17-33-22-9-5-4-6-10-22/h4-16,24H,3,17H2,1-2H3,(H,27,30)(H,28,31)(H,29,32)