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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)CNC(=O)C2=CC(=CC=C2)NC(=O)C3=C(OCCS3)C

Isomeric SMILES

CCC1=CC(=CC=C1)CNC(=O)C2=CC(=CC=C2)NC(=O)C3=C(OCCS3)C

InChI

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