(2R)-2-acetamido-N-butyl-N-methyl-3-(4-phenylmethoxyphenyl)sulfanyl-propanamide

Systemtic Name: (2R)-2-acetamido-N-butyl-N-methyl-3-(4-phenylmethoxyphenyl)sulfanyl-propanamide Openeye Name: (2R)-2-acetamido-3-(4-benzyloxyphenyl)sulfanyl-N-butyl-N-methyl-propanamide CAS Name: (2R)-2-acetamido-N-butyl-N-methyl-3-[(4-phenylmethoxyphenyl)thio]propanamide IUPAC Name: (2R)-2-acetamido-N-butyl-N-methyl-3-(4-phenylmethoxyphenyl)sulfanylpropanamide Traditional Name: (2R)-2-acetamido-3-[(4-benzoxyphenyl)thio]-N-butyl-N-methyl-propionamide Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O3S/c1-4-5-15-25(3)23(27)22(24-18(2)26)17-29-21-13-11-20(12-14-21)28-16-19-9-7-6-8-10-19/h6-14,22H,4-5,15-17H2,1-3H3,(H,24,26)/t22-/m0/s1