4-[[2-(3-methylbutyldisulfanyl)ethylcarbamothioylamino]methyl]-N-methylsulfanyl-benzamide

Systemtic Name: 4-[[2-(3-methylbutyldisulfanyl)ethylcarbamothioylamino]methyl]-N-methylsulfanyl-benzamide Openeye Name: 4-[[2-(isopentyldisulfanyl)ethylcarbamothioylamino]methyl]-N-methylsulfanyl-benzamide CAS Name: 4-[[[[2-(3-methylbutyldisulfanyl)ethylamino]-sulfanylidenemethyl]amino]methyl]-N-(methylthio)benzamide IUPAC Name: 4-[[2-(3-methylbutyldisulfanyl)ethylcarbamothioylamino]methyl]-N-methylsulfanylbenzamide Traditional Name: 4-[[2-(isoamyldisulfanyl)ethylthiocarbamoylamino]methyl]-N-(methylthio)benzamide Formula: C17H27N3OS4 MolecularWeight: 417.67578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSSCCNC(=S)NCC1=CC=C(C=C1)C(=O)NSC

Isomeric SMILES

CC(C)CCSSCCNC(=S)NCC1=CC=C(C=C1)C(=O)NSC

InChI

InChI=1S/C17H27N3OS4/c1-13(2)8-10-24-25-11-9-18-17(22)19-12-14-4-6-15(7-5-14)16(21)20-23-3/h4-7,13H,8-12H2,1-3H3,(H,20,21)(H2,18,19,22)