N-[2-methyl-5-(1-phenylethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[2-methyl-5-(1-phenylethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[2-methyl-5-(1-phenylethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[2-methyl-5-[oxo-(1-phenylethylamino)methyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[2-methyl-5-(1-phenylethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[2-methyl-5-(1-phenylethylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(C)C2=CC=CC=C2)NC(=O)C3=CSCCO3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(C)C2=CC=CC=C2)NC(=O)C3=CSCCO3

InChI

InChI=1S/C21H22N2O3S/c1-14-8-9-17(20(24)22-15(2)16-6-4-3-5-7-16)12-18(14)23-21(25)19-13-27-11-10-26-19/h3-9,12-13,15H,10-11H2,1-2H3,(H,22,24)(H,23,25)