(2R)-2-acetamido-N-[(4-methylphenyl)methyl]-3-(4-phenoxyphenyl)sulfanyl-propanamide

Systemtic Name: (2R)-2-acetamido-N-[(4-methylphenyl)methyl]-3-(4-phenoxyphenyl)sulfanyl-propanamide Openeye Name: (2R)-2-acetamido-3-(4-phenoxyphenyl)sulfanyl-N-(p-tolylmethyl)propanamide CAS Name: (2R)-2-acetamido-N-[(4-methylphenyl)methyl]-3-[(4-phenoxyphenyl)thio]propanamide IUPAC Name: (2R)-2-acetamido-N-[(4-methylphenyl)methyl]-3-(4-phenoxyphenyl)sulfanylpropanamide Traditional Name: (2R)-2-acetamido-N-(4-methylbenzyl)-3-[(4-phenoxyphenyl)thio]propionamide Formula: C25H26N2O3S MolecularWeight: 434.55054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C(CSC2=CC=C(C=C2)OC3=CC=CC=C3)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)[C@H](CSC2=CC=C(C=C2)OC3=CC=CC=C3)NC(=O)C

InChI

InChI=1S/C25H26N2O3S/c1-18-8-10-20(11-9-18)16-26-25(29)24(27-19(2)28)17-31-23-14-12-22(13-15-23)30-21-6-4-3-5-7-21/h3-15,24H,16-17H2,1-2H3,(H,26,29)(H,27,28)/t24-/m0/s1