3-[(2Z)-2-[1,3-benzothiazol-2-yl(cyano)methylidene]hydrazinyl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[(2Z)-2-[1,3-benzothiazol-2-yl(cyano)methylidene]hydrazinyl]-N,N-diethyl-benzenesulfonamide Openeye Name: (2Z)-N-[3-(diethylsulfamoyl)anilino]-1,3-benzothiazole-2-carboximidoyl cyanide CAS Name: 3-[(2Z)-2-[1,3-benzothiazol-2-yl(cyano)methylidene]hydrazinyl]-N,N-diethylbenzenesulfonamide IUPAC Name: (2Z)-N-[3-(diethylsulfamoyl)anilino]-1,3-benzothiazole-2-carboximidoyl cyanide Traditional Name: 3-[(N'Z)-N'-[1,3-benzothiazol-2-yl(cyano)methylene]hydrazino]-N,N-diethyl-benzenesulfonamide Formula: C19H19N5O2S2 MolecularWeight: 413.51646

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)NN=C(C#N)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)N/N=C(/C#N)\C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H19N5O2S2/c1-3-24(4-2)28(25,26)15-9-7-8-14(12-15)22-23-17(13-20)19-21-16-10-5-6-11-18(16)27-19/h5-12,22H,3-4H2,1-2H3/b23-17-