(2S)-N-(2-oxidanylidenethiolan-3-yl)-2-(2-phenoxyethanoylamino)-3-phenyl-propanamide

Systemtic Name: (2S)-N-(2-oxidanylidenethiolan-3-yl)-2-(2-phenoxyethanoylamino)-3-phenyl-propanamide Openeye Name: (2S)-N-(2-oxotetrahydrothiophen-3-yl)-2-[(2-phenoxyacetyl)amino]-3-phenyl-propanamide CAS Name: (2S)-2-[(1-oxo-2-phenoxyethyl)amino]-N-(2-oxo-3-thiolanyl)-3-phenylpropanamide IUPAC Name: (2S)-N-(2-oxothiolan-3-yl)-2-[(2-phenoxyacetyl)amino]-3-phenylpropanamide Traditional Name: (2S)-N-(2-ketotetrahydrothiophen-3-yl)-2-[(2-phenoxyacetyl)amino]-3-phenyl-propionamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=O)C1NC(=O)C(CC2=CC=CC=C2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

C1CSC(=O)C1NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4S/c24-19(14-27-16-9-5-2-6-10-16)22-18(13-15-7-3-1-4-8-15)20(25)23-17-11-12-28-21(17)26/h1-10,17-18H,11-14H2,(H,22,24)(H,23,25)/t17?,18-/m0/s1