N-(3-chloranyl-4-methoxy-phenyl)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: N-(3-chloro-4-methoxyphenyl)-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C20H23ClN2O4S MolecularWeight: 422.92562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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