6-(4-fluoranylphenoxy)-N-methyl-N-[4-methyl-5-[[(3S)-3-methylpiperazin-1-yl]methyl]pyridin-2-yl]pyridine-3-carboxamide

Systemtic Name: 6-(4-fluoranylphenoxy)-N-methyl-N-[4-methyl-5-[[(3S)-3-methylpiperazin-1-yl]methyl]pyridin-2-yl]pyridine-3-carboxamide Openeye Name: 6-(4-fluorophenoxy)-N-methyl-N-[4-methyl-5-[[(3S)-3-methylpiperazin-1-yl]methyl]-2-pyridyl]pyridine-3-carboxamide CAS Name: 6-(4-fluorophenoxy)-N-methyl-N-[4-methyl-5-[[(3S)-3-methyl-1-piperazinyl]methyl]-2-pyridinyl]-3-pyridinecarboxamide IUPAC Name: 6-(4-fluorophenoxy)-N-methyl-N-[4-methyl-5-[[(3S)-3-methylpiperazin-1-yl]methyl]pyridin-2-yl]pyridine-3-carboxamide Traditional Name: 6-(4-fluorophenoxy)-N-methyl-N-[4-methyl-5-[[(3S)-3-methylpiperazino]methyl]-2-pyridyl]nicotinamide Formula: C25H28FN5O2 MolecularWeight: 449.520523

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)CC2=CN=C(C=C2C)N(C)C(=O)C3=CN=C(C=C3)OC4=CC=C(C=C4)F

Isomeric SMILES

C[C@H]1CN(CCN1)CC2=CN=C(C=C2C)N(C)C(=O)C3=CN=C(C=C3)OC4=CC=C(C=C4)F

InChI

InChI=1S/C25H28FN5O2/c1-17-12-23(28-14-20(17)16-31-11-10-27-18(2)15-31)30(3)25(32)19-4-9-24(29-13-19)33-22-7-5-21(26)6-8-22/h4-9,12-14,18,27H,10-11,15-16H2,1-3H3/t18-/m0/s1