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

Systemtic Name: N-[5-[(4-ethylphenyl)methylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[5-[(4-ethylphenyl)methylcarbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[5-[[(4-ethylphenyl)methylamino]-oxomethyl]-2-methylphenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[5-[(4-ethylphenyl)methylcarbamoyl]-2-methylphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[5-[(4-ethylbenzyl)carbamoyl]-2-methyl-phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)C)NC(=O)C3=CSCCO3

Isomeric SMILES

CCC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)C)NC(=O)C3=CSCCO3

InChI

InChI=1S/C22H24N2O3S/c1-3-16-5-7-17(8-6-16)13-23-21(25)18-9-4-15(2)19(12-18)24-22(26)20-14-28-11-10-27-20/h4-9,12,14H,3,10-11,13H2,1-2H3,(H,23,25)(H,24,26)