N-[4-chloranyl-3-[oxidanyl(propan-2-yloxy)methyl]phenyl]-6-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide

Systemtic Name: N-[4-chloranyl-3-[oxidanyl(propan-2-yloxy)methyl]phenyl]-6-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide Openeye Name: N-[4-chloro-3-[hydroxy(isopropoxy)methyl]phenyl]-6-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide CAS Name: N-[4-chloro-3-[hydroxy(propan-2-yloxy)methyl]phenyl]-6-phenyl-2,3-dihydro-1,4-oxathiin-5-carboxamide IUPAC Name: N-[4-chloro-3-[hydroxy(propan-2-yloxy)methyl]phenyl]-6-phenyl-2,3-dihydro-1,4-oxathiine-5-carboxamide Traditional Name: N-[4-chloro-3-[hydroxy(isopropoxy)methyl]phenyl]-6-phenyl-2,3-dihydro-1,4-oxathiin-5-carboxamide Formula: C21H22ClNO4S MolecularWeight: 419.92168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(C1=C(C=CC(=C1)NC(=O)C2=C(OCCS2)C3=CC=CC=C3)Cl)O

Isomeric SMILES

CC(C)OC(C1=C(C=CC(=C1)NC(=O)C2=C(OCCS2)C3=CC=CC=C3)Cl)O

InChI

InChI=1S/C21H22ClNO4S/c1-13(2)27-21(25)16-12-15(8-9-17(16)22)23-20(24)19-18(26-10-11-28-19)14-6-4-3-5-7-14/h3-9,12-13,21,25H,10-11H2,1-2H3,(H,23,24)