N-(3-chloranyl-4-methyl-phenyl)-2-[3-(2-phenoxyethanoylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[3-(2-phenoxyethanoylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[3-[(2-phenoxyacetyl)amino]phenyl]sulfanyl-propanamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[[3-[(1-oxo-2-phenoxyethyl)amino]phenyl]thio]propanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[3-[(2-phenoxyacetyl)amino]phenyl]sulfanylpropanamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[[3-[(2-phenoxyacetyl)amino]phenyl]thio]propionamide Formula: C24H23ClN2O3S MolecularWeight: 454.96902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)COC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)COC3=CC=CC=C3)Cl

InChI

InChI=1S/C24H23ClN2O3S/c1-16-11-12-19(14-22(16)25)27-24(29)17(2)31-21-10-6-7-18(13-21)26-23(28)15-30-20-8-4-3-5-9-20/h3-14,17H,15H2,1-2H3,(H,26,28)(H,27,29)