methyl 3-[[2-(ethanoylsulfanylmethyl)-3-phenyl-propanoyl]amino]-2-naphthalen-2-yl-propanoate

Systemtic Name: methyl 3-[[2-(ethanoylsulfanylmethyl)-3-phenyl-propanoyl]amino]-2-naphthalen-2-yl-propanoate Openeye Name: methyl 3-[[2-(acetylsulfanylmethyl)-3-phenyl-propanoyl]amino]-2-(2-naphthyl)propanoate CAS Name: 3-[[2-[(acetylthio)methyl]-1-oxo-3-phenylpropyl]amino]-2-(2-naphthalenyl)propanoic acid methyl ester IUPAC Name: methyl 3-[[2-(acetylsulfanylmethyl)-3-phenylpropanoyl]amino]-2-naphthalen-2-ylpropanoate Traditional Name: 3-[[2-[(acetylthio)methyl]-3-phenyl-propanoyl]amino]-2-(2-naphthyl)propionic acid methyl ester Formula: C26H27NO4S MolecularWeight: 449.56188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CC1=CC=CC=C1)C(=O)NCC(C2=CC3=CC=CC=C3C=C2)C(=O)OC

Isomeric SMILES

CC(=O)SCC(CC1=CC=CC=C1)C(=O)NCC(C2=CC3=CC=CC=C3C=C2)C(=O)OC

InChI

InChI=1S/C26H27NO4S/c1-18(28)32-17-23(14-19-8-4-3-5-9-19)25(29)27-16-24(26(30)31-2)22-13-12-20-10-6-7-11-21(20)15-22/h3-13,15,23-24H,14,16-17H2,1-2H3,(H,27,29)