4-methylsulfanyl-2-(2-phenoxyethanoylamino)-N-(3-propan-2-ylphenyl)butanamide

Systemtic Name: 4-methylsulfanyl-2-(2-phenoxyethanoylamino)-N-(3-propan-2-ylphenyl)butanamide Openeye Name: N-(3-isopropylphenyl)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: 4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]-N-(3-propan-2-ylphenyl)butanamide IUPAC Name: 4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]-N-(3-propan-2-ylphenyl)butanamide Traditional Name: N-m-cumenyl-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)NC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC(C)C1=CC(=CC=C1)NC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C22H28N2O3S/c1-16(2)17-8-7-9-18(14-17)23-22(26)20(12-13-28-3)24-21(25)15-27-19-10-5-4-6-11-19/h4-11,14,16,20H,12-13,15H2,1-3H3,(H,23,26)(H,24,25)