4-[4-(2-fluorophenyl)piperazin-1-yl]-N,N-dimethyl-2-(propylamino)pyridine-3-carboxamide

Systemtic Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-N,N-dimethyl-2-(propylamino)pyridine-3-carboxamide Openeye Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-N,N-dimethyl-2-(propylamino)pyridine-3-carboxamide CAS Name: 4-[4-(2-fluorophenyl)-1-piperazinyl]-N,N-dimethyl-2-(propylamino)-3-pyridinecarboxamide IUPAC Name: 4-[4-(2-fluorophenyl)piperazin-1-yl]-N,N-dimethyl-2-(propylamino)pyridine-3-carboxamide Traditional Name: 4-[4-(2-fluorophenyl)piperazino]-N,N-dimethyl-2-(propylamino)nicotinamide Formula: C21H28FN5O MolecularWeight: 385.478323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC=CC(=C1C(=O)N(C)C)N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CCCNC1=NC=CC(=C1C(=O)N(C)C)N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C21H28FN5O/c1-4-10-23-20-19(21(28)25(2)3)18(9-11-24-20)27-14-12-26(13-15-27)17-8-6-5-7-16(17)22/h5-9,11H,4,10,12-15H2,1-3H3,(H,23,24)