(2S)-2-acetamido-N-[(4-methoxyphenyl)methyl]-3-(4-phenylmethoxyphenyl)sulfanyl-propanamide

Systemtic Name: (2S)-2-acetamido-N-[(4-methoxyphenyl)methyl]-3-(4-phenylmethoxyphenyl)sulfanyl-propanamide Openeye Name: (2S)-2-acetamido-3-(4-benzyloxyphenyl)sulfanyl-N-[(4-methoxyphenyl)methyl]propanamide CAS Name: (2S)-2-acetamido-N-[(4-methoxyphenyl)methyl]-3-[(4-phenylmethoxyphenyl)thio]propanamide IUPAC Name: (2S)-2-acetamido-N-[(4-methoxyphenyl)methyl]-3-(4-phenylmethoxyphenyl)sulfanylpropanamide Traditional Name: (2S)-2-acetamido-3-[(4-benzoxyphenyl)thio]-N-p-anisyl-propionamide Formula: C26H28N2O4S MolecularWeight: 464.57652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)N[C@H](CSC1=CC=C(C=C1)OCC2=CC=CC=C2)C(=O)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C26H28N2O4S/c1-19(29)28-25(26(30)27-16-20-8-10-22(31-2)11-9-20)18-33-24-14-12-23(13-15-24)32-17-21-6-4-3-5-7-21/h3-15,25H,16-18H2,1-2H3,(H,27,30)(H,28,29)/t25-/m1/s1