(2S)-N-(5-chloranyl-2-methoxy-phenyl)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: (2S)-N-(5-chloranyl-2-methoxy-phenyl)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide Openeye Name: (2S)-N-(5-chloro-2-methoxy-phenyl)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: (2S)-N-(5-chloro-2-methoxyphenyl)-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: (2S)-N-(5-chloro-2-methoxyphenyl)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: (2S)-N-(5-chloro-2-methoxy-phenyl)-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C20H23ClN2O4S MolecularWeight: 422.92562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)NC(=O)C(CCSC)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)NC(=O)[C@H](CCSC)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C20H23ClN2O4S/c1-26-18-9-8-14(21)12-17(18)23-20(25)16(10-11-28-2)22-19(24)13-27-15-6-4-3-5-7-15/h3-9,12,16H,10-11,13H2,1-2H3,(H,22,24)(H,23,25)/t16-/m0/s1