methyl N'-[2-(1,2,4-oxathiazinan-4-yl)phenyl]carbamimidothioate

Systemtic Name: methyl N'-[2-(1,2,4-oxathiazinan-4-yl)phenyl]carbamimidothioate Openeye Name: 2-methyl-3-[2-(1,2,4-oxathiazinan-4-yl)phenyl]isothiourea CAS Name: N'-[2-(1,2,4-oxathiazinan-4-yl)phenyl]carbamimidothioic acid methyl ester IUPAC Name: methyl N'-[2-(1,2,4-oxathiazinan-4-yl)phenyl]carbamimidothioate Traditional Name: 2-methyl-3-[2-(1,2,4-oxathiazinan-4-yl)phenyl]isothiourea Formula: C11H15N3OS2 MolecularWeight: 269.3863

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=NC1=CC=CC=C1N2CCOSC2)N

Isomeric SMILES

CSC(=NC1=CC=CC=C1N2CCOSC2)N

InChI

InChI=1S/C11H15N3OS2/c1-16-11(12)13-9-4-2-3-5-10(9)14-6-7-15-17-8-14/h2-5H,6-8H2,1H3,(H2,12,13)