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S-(phenylmethyl) (2S)-2-benzamido-3-(4-hydroxyphenyl)propanethioate

S-(phenylmethyl) (2S)-2-benzamido-3-(4-hydroxyphenyl)propanethioate

Systemtic Name:S-(phenylmethyl) (2S)-2-benzamido-3-(4-hydroxyphenyl)propanethioate
Openeye Name:S-benzyl (2S)-2-benzamido-3-(4-hydroxyphenyl)propanethioate
CAS Name:(2S)-2-benzamido-3-(4-hydroxyphenyl)propanethioic acid S-(phenylmethyl) ester
IUPAC Name:S-benzyl (2S)-2-benzamido-3-(4-hydroxyphenyl)propanethioate
Traditional Name:(2S)-2-benzamido-3-(4-hydroxyphenyl)propanethioic acid S-benzyl ester
Formula: C23H21NO3S
MolecularWeight: 391.48274
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C3=CC=CC=C3


Isomeric SMILES

C1=CC=C(C=C1)CSC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)C3=CC=CC=C3


InChI

InChI=1S/C23H21NO3S/c25-20-13-11-17(12-14-20)15-21(24-22(26)19-9-5-2-6-10-19)23(27)28-16-18-7-3-1-4-8-18/h1-14,21,25H,15-16H2,(H,24,26)/t21-/m0/s1


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