(1R,2R)-2-(1-benzothiophen-2-yl)-N-methyl-1-oxidanylidene-thiane-2-carbothioamide

Systemtic Name: (1R,2R)-2-(1-benzothiophen-2-yl)-N-methyl-1-oxidanylidene-thiane-2-carbothioamide Openeye Name: (1R,2R)-2-(benzothiophen-2-yl)-N-methyl-1-oxo-thiane-2-carbothioamide CAS Name: (1R,2R)-2-(1-benzothiophen-2-yl)-N-methyl-1-oxo-2-thianecarbothioamide IUPAC Name: (1R,2R)-2-(1-benzothiophen-2-yl)-N-methyl-1-oxothiane-2-carbothioamide Traditional Name: (1R,2R)-2-(benzothiophen-2-yl)-1-keto-N-methyl-thiane-2-carbothioamide Formula: C15H17NOS3 MolecularWeight: 323.49658

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1(CCCCS1=O)C2=CC3=CC=CC=C3S2

Isomeric SMILES

CNC(=S)[C@@]1(CCCC[S@]1=O)C2=CC3=CC=CC=C3S2

InChI

InChI=1S/C15H17NOS3/c1-16-14(18)15(8-4-5-9-20(15)17)13-10-11-6-2-3-7-12(11)19-13/h2-3,6-7,10H,4-5,8-9H2,1H3,(H,16,18)/t15-,20-/m1/s1