2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-(furan-2-ylmethyl)propanamide

Systemtic Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-(furan-2-ylmethyl)propanamide Openeye Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-(2-furylmethyl)propanamide CAS Name: 2-[[1-(2-cyanoethyl)-2-benzimidazolyl]thio]-N-(2-furanylmethyl)propanamide IUPAC Name: 2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanyl-N-(furan-2-ylmethyl)propanamide Traditional Name: 2-[[1-(2-cyanoethyl)benzimidazol-2-yl]thio]-N-(2-furfuryl)propionamide Formula: C18H18N4O2S MolecularWeight: 354.42612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)SC2=NC3=CC=CC=C3N2CCC#N

Isomeric SMILES

CC(C(=O)NCC1=CC=CO1)SC2=NC3=CC=CC=C3N2CCC#N

InChI

InChI=1S/C18H18N4O2S/c1-13(17(23)20-12-14-6-4-11-24-14)25-18-21-15-7-2-3-8-16(15)22(18)10-5-9-19/h2-4,6-8,11,13H,5,10,12H2,1H3,(H,20,23)