(2R)-2-acetamido-3-(4-phenoxyphenyl)sulfanyl-N-[(1R)-1-phenylethyl]propanamide

Systemtic Name: (2R)-2-acetamido-3-(4-phenoxyphenyl)sulfanyl-N-[(1R)-1-phenylethyl]propanamide Openeye Name: (2R)-2-acetamido-3-(4-phenoxyphenyl)sulfanyl-N-[(1R)-1-phenylethyl]propanamide CAS Name: (2R)-2-acetamido-3-[(4-phenoxyphenyl)thio]-N-[(1R)-1-phenylethyl]propanamide IUPAC Name: (2R)-2-acetamido-3-(4-phenoxyphenyl)sulfanyl-N-[(1R)-1-phenylethyl]propanamide Traditional Name: (2R)-2-acetamido-3-[(4-phenoxyphenyl)thio]-N-[(1R)-1-phenylethyl]propionamide Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(CSC2=CC=C(C=C2)OC3=CC=CC=C3)NC(=O)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)[C@H](CSC2=CC=C(C=C2)OC3=CC=CC=C3)NC(=O)C

InChI

InChI=1S/C25H26N2O3S/c1-18(20-9-5-3-6-10-20)26-25(29)24(27-19(2)28)17-31-23-15-13-22(14-16-23)30-21-11-7-4-8-12-21/h3-16,18,24H,17H2,1-2H3,(H,26,29)(H,27,28)/t18-,24+/m1/s1