3-fluoranyl-5-(3-pentan-3-yl-2-sulfanylidene-1H-benzimidazol-5-yl)benzenecarbonitrile

Systemtic Name: 3-fluoranyl-5-(3-pentan-3-yl-2-sulfanylidene-1H-benzimidazol-5-yl)benzenecarbonitrile Openeye Name: 3-[3-(1-ethylpropyl)-2-thioxo-1H-benzimidazol-5-yl]-5-fluoro-benzonitrile CAS Name: 3-fluoro-5-(3-pentan-3-yl-2-sulfanylidene-1H-benzimidazol-5-yl)benzonitrile IUPAC Name: 3-fluoro-5-(3-pentan-3-yl-2-sulfanylidene-1H-benzimidazol-5-yl)benzonitrile Traditional Name: 3-[3-(1-ethylpropyl)-2-thioxo-1H-benzimidazol-5-yl]-5-fluoro-benzonitrile Formula: C19H18FN3S MolecularWeight: 339.429723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C2=C(C=CC(=C2)C3=CC(=CC(=C3)C#N)F)NC1=S

Isomeric SMILES

CCC(CC)N1C2=C(C=CC(=C2)C3=CC(=CC(=C3)C#N)F)NC1=S

InChI

InChI=1S/C19H18FN3S/c1-3-16(4-2)23-18-10-13(5-6-17(18)22-19(23)24)14-7-12(11-21)8-15(20)9-14/h5-10,16H,3-4H2,1-2H3,(H,22,24)