3-(aminocarbonylamino)-N-[2-(azepan-1-yl)phenyl]-3-(2-fluorophenyl)propanamide

Systemtic Name: 3-(aminocarbonylamino)-N-[2-(azepan-1-yl)phenyl]-3-(2-fluorophenyl)propanamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-3-(2-fluorophenyl)-3-ureido-propanamide CAS Name: N-[2-(1-azepanyl)phenyl]-3-(carbamoylamino)-3-(2-fluorophenyl)propanamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-3-(carbamoylamino)-3-(2-fluorophenyl)propanamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-3-(2-fluorophenyl)-3-ureido-propionamide Formula: C22H27FN4O2 MolecularWeight: 398.473783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=CC=C2NC(=O)CC(C3=CC=CC=C3F)NC(=O)N

Isomeric SMILES

C1CCCN(CC1)C2=CC=CC=C2NC(=O)CC(C3=CC=CC=C3F)NC(=O)N

InChI

InChI=1S/C22H27FN4O2/c23-17-10-4-3-9-16(17)19(26-22(24)29)15-21(28)25-18-11-5-6-12-20(18)27-13-7-1-2-8-14-27/h3-6,9-12,19H,1-2,7-8,13-15H2,(H,25,28)(H3,24,26,29)