(2S)-2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(2S)-2-phenylbutyl]propanamide

Systemtic Name: (2S)-2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(2S)-2-phenylbutyl]propanamide Openeye Name: (2S)-2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(2S)-2-phenylbutyl]propanamide CAS Name: (2S)-2-(1,3-benzoxazol-2-ylthio)-N-[(2S)-2-phenylbutyl]propanamide IUPAC Name: (2S)-2-(1,3-benzoxazol-2-ylsulfanyl)-N-[(2S)-2-phenylbutyl]propanamide Traditional Name: (2S)-2-(1,3-benzoxazol-2-ylthio)-N-[(2S)-2-phenylbutyl]propionamide Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C(C)SC1=NC2=CC=CC=C2O1)C3=CC=CC=C3

Isomeric SMILES

CC[C@H](CNC(=O)[C@H](C)SC1=NC2=CC=CC=C2O1)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O2S/c1-3-15(16-9-5-4-6-10-16)13-21-19(23)14(2)25-20-22-17-11-7-8-12-18(17)24-20/h4-12,14-15H,3,13H2,1-2H3,(H,21,23)/t14-,15+/m0/s1