N-[(3-chlorophenyl)methyl]-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-4-methylsulfanyl-2-(2-phenoxyethanoylamino)butanamide Openeye Name: N-[(3-chlorophenyl)methyl]-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: N-[(3-chlorophenyl)methyl]-4-(methylthio)-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: N-[(3-chlorophenyl)methyl]-4-methylsulfanyl-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: N-(3-chlorobenzyl)-4-(methylthio)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C20H23ClN2O3S MolecularWeight: 406.92622

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CC(=CC=C1)Cl)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CSCCC(C(=O)NCC1=CC(=CC=C1)Cl)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C20H23ClN2O3S/c1-27-11-10-18(20(25)22-13-15-6-5-7-16(21)12-15)23-19(24)14-26-17-8-3-2-4-9-17/h2-9,12,18H,10-11,13-14H2,1H3,(H,22,25)(H,23,24)