(2R)-2-acetamido-N-[(2R)-2-oxidanylpropyl]-3-(4-phenylmethoxyphenyl)sulfanyl-propanamide

Systemtic Name: (2R)-2-acetamido-N-[(2R)-2-oxidanylpropyl]-3-(4-phenylmethoxyphenyl)sulfanyl-propanamide Openeye Name: (2R)-2-acetamido-3-(4-benzyloxyphenyl)sulfanyl-N-[(2R)-2-hydroxypropyl]propanamide CAS Name: (2R)-2-acetamido-N-[(2R)-2-hydroxypropyl]-3-[(4-phenylmethoxyphenyl)thio]propanamide IUPAC Name: (2R)-2-acetamido-N-[(2R)-2-hydroxypropyl]-3-(4-phenylmethoxyphenyl)sulfanylpropanamide Traditional Name: (2R)-2-acetamido-3-[(4-benzoxyphenyl)thio]-N-[(2R)-2-hydroxypropyl]propionamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C(CSC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C)O

Isomeric SMILES

C[C@H](CNC(=O)[C@H](CSC1=CC=C(C=C1)OCC2=CC=CC=C2)NC(=O)C)O

InChI

InChI=1S/C21H26N2O4S/c1-15(24)12-22-21(26)20(23-16(2)25)14-28-19-10-8-18(9-11-19)27-13-17-6-4-3-5-7-17/h3-11,15,20,24H,12-14H2,1-2H3,(H,22,26)(H,23,25)/t15-,20+/m1/s1