prop-2-enyl (2S)-3-phenyl-2-[[5-(phenylcarbamoyl)-2,3-dihydro-1,4-oxathiin-6-yl]methylamino]propanoate

Systemtic Name: prop-2-enyl (2S)-3-phenyl-2-[[5-(phenylcarbamoyl)-2,3-dihydro-1,4-oxathiin-6-yl]methylamino]propanoate Openeye Name: allyl (2S)-3-phenyl-2-[[5-(phenylcarbamoyl)-2,3-dihydro-1,4-oxathiin-6-yl]methylamino]propanoate CAS Name: (2S)-2-[[5-[anilino(oxo)methyl]-2,3-dihydro-1,4-oxathiin-6-yl]methylamino]-3-phenylpropanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S)-3-phenyl-2-[[5-(phenylcarbamoyl)-2,3-dihydro-1,4-oxathiin-6-yl]methylamino]propanoate Traditional Name: (2S)-3-phenyl-2-[[5-(phenylcarbamoyl)-2,3-dihydro-1,4-oxathiin-6-yl]methylamino]propionic acid allyl ester Formula: C24H26N2O4S MolecularWeight: 438.53924

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(CC1=CC=CC=C1)NCC2=C(SCCO2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C=CCOC(=O)[C@H](CC1=CC=CC=C1)NCC2=C(SCCO2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C24H26N2O4S/c1-2-13-30-24(28)20(16-18-9-5-3-6-10-18)25-17-21-22(31-15-14-29-21)23(27)26-19-11-7-4-8-12-19/h2-12,20,25H,1,13-17H2,(H,26,27)/t20-/m0/s1