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

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

C1CSC=C(O1)C(=O)NC2=CC=C(C=C2)C(=O)NCCCC3=CC=CC=C3

Isomeric SMILES

C1CSC=C(O1)C(=O)NC2=CC=C(C=C2)C(=O)NCCCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O3S/c24-20(22-12-4-7-16-5-2-1-3-6-16)17-8-10-18(11-9-17)23-21(25)19-15-27-14-13-26-19/h1-3,5-6,8-11,15H,4,7,12-14H2,(H,22,24)(H,23,25)