(2S)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)-N-(2-phenoxyethyl)butanamide

Systemtic Name: (2S)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)-N-(2-phenoxyethyl)butanamide Openeye Name: (2S)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]-N-(2-phenoxyethyl)butanamide CAS Name: (2S)-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]-N-(2-phenoxyethyl)butanamide IUPAC Name: (2S)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]-N-(2-phenoxyethyl)butanamide Traditional Name: (2S)-4-(methylthio)-2-[(2-phenoxyacetyl)amino]-N-(2-phenoxyethyl)butyramide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCCOC1=CC=CC=C1)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CSCC[C@@H](C(=O)NCCOC1=CC=CC=C1)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O4S/c1-28-15-12-19(23-20(24)16-27-18-10-6-3-7-11-18)21(25)22-13-14-26-17-8-4-2-5-9-17/h2-11,19H,12-16H2,1H3,(H,22,25)(H,23,24)/t19-/m0/s1