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

Systemtic Name: N-[4-chloranyl-3-[oxidanyl(propan-2-yloxy)methyl]phenyl]-2,3-dihydro-1,4-oxathiine-5-carbothioamide Openeye Name: N-[4-chloro-3-[hydroxy(isopropoxy)methyl]phenyl]-2,3-dihydro-1,4-oxathiine-5-carbothioamide CAS Name: N-[4-chloro-3-[hydroxy(propan-2-yloxy)methyl]phenyl]-2,3-dihydro-1,4-oxathiin-5-carbothioamide IUPAC Name: N-[4-chloro-3-[hydroxy(propan-2-yloxy)methyl]phenyl]-2,3-dihydro-1,4-oxathiine-5-carbothioamide Traditional Name: N-[4-chloro-3-[hydroxy(isopropoxy)methyl]phenyl]-2,3-dihydro-1,4-oxathiin-5-carbothioamide Formula: C15H18ClNO3S2 MolecularWeight: 359.89132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(C1=C(C=CC(=C1)NC(=S)C2=COCCS2)Cl)O

Isomeric SMILES

CC(C)OC(C1=C(C=CC(=C1)NC(=S)C2=COCCS2)Cl)O

InChI

InChI=1S/C15H18ClNO3S2/c1-9(2)20-15(18)11-7-10(3-4-12(11)16)17-14(21)13-8-19-5-6-22-13/h3-4,7-9,15,18H,5-6H2,1-2H3,(H,17,21)