2-(1,3-benzothiazol-2-ylsulfanyl)-N,N'-dimethyl-butanediamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N,N'-dimethyl-butanediamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N,N'-dimethyl-butanediamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N,N'-dimethylbutanediamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N,N'-dimethylbutanediamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N,N'-dimethyl-succinamide Formula: C13H15N3O2S2 MolecularWeight: 309.4071

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CC(C(=O)NC)SC1=NC2=CC=CC=C2S1

Isomeric SMILES

CNC(=O)CC(C(=O)NC)SC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C13H15N3O2S2/c1-14-11(17)7-10(12(18)15-2)20-13-16-8-5-3-4-6-9(8)19-13/h3-6,10H,7H2,1-2H3,(H,14,17)(H,15,18)