3-[2-[(2-chloranylquinolin-3-yl)methylsulfanyl]benzimidazol-1-yl]propanenitrile

Systemtic Name: 3-[2-[(2-chloranylquinolin-3-yl)methylsulfanyl]benzimidazol-1-yl]propanenitrile Openeye Name: 3-[2-[(2-chloro-3-quinolyl)methylsulfanyl]benzimidazol-1-yl]propanenitrile CAS Name: 3-[2-[(2-chloro-3-quinolinyl)methylthio]-1-benzimidazolyl]propanenitrile IUPAC Name: 3-[2-[(2-chloroquinolin-3-yl)methylsulfanyl]benzimidazol-1-yl]propanenitrile Traditional Name: 3-[2-[(2-chloro-3-quinolyl)methylthio]benzimidazol-1-yl]propionitrile Formula: C20H15ClN4S MolecularWeight: 378.8779

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CSC3=NC4=CC=CC=C4N3CCC#N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=N2)Cl)CSC3=NC4=CC=CC=C4N3CCC#N

InChI

InChI=1S/C20H15ClN4S/c21-19-15(12-14-6-1-2-7-16(14)23-19)13-26-20-24-17-8-3-4-9-18(17)25(20)11-5-10-22/h1-4,6-9,12H,5,11,13H2