2-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propylsulfanyl]-6-thiophen-2-yl-pyridine-3-carbonitrile

Systemtic Name: 2-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propylsulfanyl]-6-thiophen-2-yl-pyridine-3-carbonitrile Openeye Name: 2-[3-(2-oxo-3H-benzimidazol-1-yl)propylsulfanyl]-6-(2-thienyl)pyridine-3-carbonitrile CAS Name: 2-[3-(2-oxo-3H-benzimidazol-1-yl)propylthio]-6-thiophen-2-yl-3-pyridinecarbonitrile IUPAC Name: 2-[3-(2-oxo-3H-benzimidazol-1-yl)propylsulfanyl]-6-thiophen-2-ylpyridine-3-carbonitrile Traditional Name: 2-[3-(2-keto-3H-benzimidazol-1-yl)propylthio]-6-(2-thienyl)nicotinonitrile Formula: C20H16N4OS2 MolecularWeight: 392.49724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)N2CCCSC3=C(C=CC(=N3)C4=CC=CS4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)N2CCCSC3=C(C=CC(=N3)C4=CC=CS4)C#N

InChI

InChI=1S/C20H16N4OS2/c21-13-14-8-9-16(18-7-3-11-26-18)22-19(14)27-12-4-10-24-17-6-2-1-5-15(17)23-20(24)25/h1-3,5-9,11H,4,10,12H2,(H,23,25)