2-[3-[bis(4-fluorophenyl)amino]-4-propyl-piperazin-1-yl]pyridine-3-carboxamide dihydrochloride

Systemtic Name: 2-[3-[bis(4-fluorophenyl)amino]-4-propyl-piperazin-1-yl]pyridine-3-carboxamide dihydrochloride Openeye Name: 2-[3-(4-fluoro-N-(4-fluorophenyl)anilino)-4-propyl-piperazin-1-yl]pyridine-3-carboxamide dihydrochloride CAS Name: 2-[3-(4-fluoro-N-(4-fluorophenyl)anilino)-4-propyl-1-piperazinyl]-3-pyridinecarboxamide dihydrochloride IUPAC Name: 2-[3-(4-fluoro-N-(4-fluorophenyl)anilino)-4-propylpiperazin-1-yl]pyridine-3-carboxamide dihydrochloride Traditional Name: 2-[3-(4-fluoro-N-(4-fluorophenyl)anilino)-4-propyl-piperazino]nicotinamide dihydrochloride Formula: C25H29Cl2F2N5O MolecularWeight: 524.433466

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1N(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C4=C(C=CC=N4)C(=O)N.Cl.Cl

Isomeric SMILES

CCCN1CCN(CC1N(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C4=C(C=CC=N4)C(=O)N.Cl.Cl

InChI

InChI=1S/C25H27F2N5O.2ClH/c1-2-14-30-15-16-31(25-22(24(28)33)4-3-13-29-25)17-23(30)32(20-9-5-18(26)6-10-20)21-11-7-19(27)8-12-21;;/h3-13,23H,2,14-17H2,1H3,(H2,28,33);2*1H