N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanyl-propanamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[[3-[(1-oxo-2-phenylethyl)amino]phenyl]thio]propanamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanylpropanamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-[[3-[(2-phenylacetyl)amino]phenyl]thio]propionamide Formula: C25H25ClN2O3S MolecularWeight: 468.9956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C(C)SC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C25H25ClN2O3S/c1-16-12-22(23(31-3)15-21(16)26)28-25(30)17(2)32-20-11-7-10-19(14-20)27-24(29)13-18-8-5-4-6-9-18/h4-12,14-15,17H,13H2,1-3H3,(H,27,29)(H,28,30)