N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanyl-propanamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-[[3-[(1-oxo-2-phenylethyl)amino]phenyl]thio]propanamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanylpropanamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-[[3-[(2-phenylacetyl)amino]phenyl]thio]propionamide Formula: C25H25ClN2O4S MolecularWeight: 484.995

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1OC)OC)Cl)SC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1OC)OC)Cl)SC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C25H25ClN2O4S/c1-16(25(30)28-21-14-20(26)22(31-2)15-23(21)32-3)33-19-11-7-10-18(13-19)27-24(29)12-17-8-5-4-6-9-17/h4-11,13-16H,12H2,1-3H3,(H,27,29)(H,28,30)