4-[3-[methyl(thiolan-3-yl)amino]-2-oxidanyl-propoxy]benzenecarbothioamide

Systemtic Name: 4-[3-[methyl(thiolan-3-yl)amino]-2-oxidanyl-propoxy]benzenecarbothioamide Openeye Name: 4-[2-hydroxy-3-[methyl(tetrahydrothiophen-3-yl)amino]propoxy]benzenecarbothioamide CAS Name: 4-[2-hydroxy-3-[methyl(3-thiolanyl)amino]propoxy]benzenecarbothioamide IUPAC Name: 4-[2-hydroxy-3-[methyl(thiolan-3-yl)amino]propoxy]benzenecarbothioamide Traditional Name: 4-[2-hydroxy-3-[methyl(tetrahydrothiophen-3-yl)amino]propoxy]thiobenzamide Formula: C15H22N2O2S2 MolecularWeight: 326.47738

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(COC1=CC=C(C=C1)C(=S)N)O)C2CCSC2

Isomeric SMILES

CN(CC(COC1=CC=C(C=C1)C(=S)N)O)C2CCSC2

InChI

InChI=1S/C15H22N2O2S2/c1-17(12-6-7-21-10-12)8-13(18)9-19-14-4-2-11(3-5-14)15(16)20/h2-5,12-13,18H,6-10H2,1H3,(H2,16,20)