2-(4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-propyl-pyrimidine-5-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-propyl-pyrimidine-5-carboxamide Openeye Name: 2-(4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-propyl-pyrimidine-5-carboxamide CAS Name: 2-(4-fluorophenyl)-4-[4-(2-methoxyphenyl)-1-piperazinyl]-N-propyl-5-pyrimidinecarboxamide IUPAC Name: 2-(4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazin-1-yl]-N-propylpyrimidine-5-carboxamide Traditional Name: 2-(4-fluorophenyl)-4-[4-(2-methoxyphenyl)piperazino]-N-propyl-pyrimidine-5-carboxamide Formula: C25H28FN5O2 MolecularWeight: 449.520523

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CN=C(N=C1N2CCN(CC2)C3=CC=CC=C3OC)C4=CC=C(C=C4)F

Isomeric SMILES

CCCNC(=O)C1=CN=C(N=C1N2CCN(CC2)C3=CC=CC=C3OC)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H28FN5O2/c1-3-12-27-25(32)20-17-28-23(18-8-10-19(26)11-9-18)29-24(20)31-15-13-30(14-16-31)21-6-4-5-7-22(21)33-2/h4-11,17H,3,12-16H2,1-2H3,(H,27,32)