3-(5-azanylidene-3-oxidanylidene-pyrazolidin-1-yl)-2-(1,3-benzothiazol-2-yl)-3-(5-phenylfuran-2-yl)propanenitrile

Systemtic Name: 3-(5-azanylidene-3-oxidanylidene-pyrazolidin-1-yl)-2-(1,3-benzothiazol-2-yl)-3-(5-phenylfuran-2-yl)propanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-3-(5-imino-3-oxo-pyrazolidin-1-yl)-3-(5-phenyl-2-furyl)propanenitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-3-(5-imino-3-oxo-1-pyrazolidinyl)-3-(5-phenyl-2-furanyl)propanenitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-3-(5-imino-3-oxopyrazolidin-1-yl)-3-(5-phenylfuran-2-yl)propanenitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-3-(5-imino-3-keto-pyrazolidin-1-yl)-3-(5-phenyl-2-furyl)propionitrile Formula: C23H17N5O2S MolecularWeight: 427.47838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=N)N(NC1=O)C(C2=CC=C(O2)C3=CC=CC=C3)C(C#N)C4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C(=N)N(NC1=O)C(C2=CC=C(O2)C3=CC=CC=C3)C(C#N)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H17N5O2S/c24-13-15(23-26-16-8-4-5-9-19(16)31-23)22(28-20(25)12-21(29)27-28)18-11-10-17(30-18)14-6-2-1-3-7-14/h1-11,15,22,25H,12H2,(H,27,29)