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

Systemtic Name: N-[4-[(4-methylsulfanylphenyl)methylcarbamoyl]phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[4-[(4-methylsulfanylphenyl)methylcarbamoyl]phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[4-[[[4-(methylthio)phenyl]methylamino]-oxomethyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[4-[(4-methylsulfanylphenyl)methylcarbamoyl]phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[4-[[4-(methylthio)benzyl]carbamoyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C20H20N2O3S2 MolecularWeight: 400.5144

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)NC(=O)C3=CSCCO3

Isomeric SMILES

CSC1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)NC(=O)C3=CSCCO3

InChI

InChI=1S/C20H20N2O3S2/c1-26-17-8-2-14(3-9-17)12-21-19(23)15-4-6-16(7-5-15)22-20(24)18-13-27-11-10-25-18/h2-9,13H,10-12H2,1H3,(H,21,23)(H,22,24)