2-(2,1,3-benzothiadiazol-4-yl)-3-methyl-2-morpholin-4-yl-pentanedinitrile

Systemtic Name: 2-(2,1,3-benzothiadiazol-4-yl)-3-methyl-2-morpholin-4-yl-pentanedinitrile Openeye Name: 2-(2,1,3-benzothiadiazol-4-yl)-3-methyl-2-morpholino-pentanedinitrile CAS Name: 2-(2,1,3-benzothiadiazol-4-yl)-3-methyl-2-(4-morpholinyl)pentanedinitrile IUPAC Name: 2-(2,1,3-benzothiadiazol-4-yl)-3-methyl-2-morpholin-4-ylpentanedinitrile Traditional Name: 3-methyl-2-morpholino-2-piazthiol-4-yl-glutaronitrile Formula: C16H17N5OS MolecularWeight: 327.40408

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#N)C(C#N)(C1=CC=CC2=NSN=C21)N3CCOCC3

Isomeric SMILES

CC(CC#N)C(C#N)(C1=CC=CC2=NSN=C21)N3CCOCC3

InChI

InChI=1S/C16H17N5OS/c1-12(5-6-17)16(11-18,21-7-9-22-10-8-21)13-3-2-4-14-15(13)20-23-19-14/h2-4,12H,5,7-10H2,1H3