(E)-3-(2-azanyl-3-cyclopentyl-benzimidazol-5-yl)-3-(2-fluorophenyl)prop-2-enamide

Systemtic Name: (E)-3-(2-azanyl-3-cyclopentyl-benzimidazol-5-yl)-3-(2-fluorophenyl)prop-2-enamide Openeye Name: (E)-3-(2-amino-3-cyclopentyl-benzimidazol-5-yl)-3-(2-fluorophenyl)prop-2-enamide CAS Name: (E)-3-(2-amino-3-cyclopentyl-5-benzimidazolyl)-3-(2-fluorophenyl)-2-propenamide IUPAC Name: (E)-3-(2-amino-3-cyclopentylbenzimidazol-5-yl)-3-(2-fluorophenyl)prop-2-enamide Traditional Name: (E)-3-(2-amino-3-cyclopentyl-benzimidazol-5-yl)-3-(2-fluorophenyl)acrylamide Formula: C21H21FN4O MolecularWeight: 364.416043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C=CC(=C3)C(=CC(=O)N)C4=CC=CC=C4F)N=C2N

Isomeric SMILES

C1CCC(C1)N2C3=C(C=CC(=C3)/C(=C\C(=O)N)/C4=CC=CC=C4F)N=C2N

InChI

InChI=1S/C21H21FN4O/c22-17-8-4-3-7-15(17)16(12-20(23)27)13-9-10-18-19(11-13)26(21(24)25-18)14-5-1-2-6-14/h3-4,7-12,14H,1-2,5-6H2,(H2,23,27)(H2,24,25)/b16-12+