N-[4-(2-phenylpropylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[4-(2-phenylpropylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[4-(2-phenylpropylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[4-[oxo-(2-phenylpropylamino)methyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[4-(2-phenylpropylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[4-(2-phenylpropylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=CC=C(C=C1)NC(=O)C2=CSCCO2)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)C1=CC=C(C=C1)NC(=O)C2=CSCCO2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O3S/c1-15(16-5-3-2-4-6-16)13-22-20(24)17-7-9-18(10-8-17)23-21(25)19-14-27-12-11-26-19/h2-10,14-15H,11-13H2,1H3,(H,22,24)(H,23,25)