4-[[6-(2-azanyl-1,3-thiazolidin-2-yl)-6-oxidanylidene-hexyl]amino]benzene-1,2-dicarbonitrile

Systemtic Name: 4-[[6-(2-azanyl-1,3-thiazolidin-2-yl)-6-oxidanylidene-hexyl]amino]benzene-1,2-dicarbonitrile Openeye Name: 4-[[6-(2-aminothiazolidin-2-yl)-6-oxo-hexyl]amino]phthalonitrile CAS Name: 4-[[6-(2-amino-2-thiazolidinyl)-6-oxohexyl]amino]benzene-1,2-dicarbonitrile IUPAC Name: 4-[[6-(2-amino-1,3-thiazolidin-2-yl)-6-oxohexyl]amino]benzene-1,2-dicarbonitrile Traditional Name: 4-[[6-(2-aminothiazolidin-2-yl)-6-keto-hexyl]amino]phthalonitrile Formula: C17H21N5OS MolecularWeight: 343.44654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CSC(N1)(C(=O)CCCCCNC2=CC(=C(C=C2)C#N)C#N)N

Isomeric SMILES

C1CSC(N1)(C(=O)CCCCCNC2=CC(=C(C=C2)C#N)C#N)N

InChI

InChI=1S/C17H21N5OS/c18-11-13-5-6-15(10-14(13)12-19)21-7-3-1-2-4-16(23)17(20)22-8-9-24-17/h5-6,10,21-22H,1-4,7-9,20H2