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

Systemtic Name: N-[4-(3-propylsulfanylpropylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[4-(3-propylsulfanylpropylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[4-[oxo-[3-(propylthio)propylamino]methyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[4-(3-propylsulfanylpropylcarbamoyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[4-[3-(propylthio)propylcarbamoyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C18H24N2O3S2 MolecularWeight: 380.52476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSCCCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CSCCO2

Isomeric SMILES

CCCSCCCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CSCCO2

InChI

InChI=1S/C18H24N2O3S2/c1-2-10-24-11-3-8-19-17(21)14-4-6-15(7-5-14)20-18(22)16-13-25-12-9-23-16/h4-7,13H,2-3,8-12H2,1H3,(H,19,21)(H,20,22)