N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-3-[(4-methylphenyl)carbonylamino]pyrazine-2-carboxamide

Systemtic Name: N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-3-[(4-methylphenyl)carbonylamino]pyrazine-2-carboxamide Openeye Name: N-[1-[(3-fluorophenyl)methyl]-4-piperidyl]-3-[(4-methylbenzoyl)amino]pyrazine-2-carboxamide CAS Name: N-[1-[(3-fluorophenyl)methyl]-4-piperidinyl]-3-[[(4-methylphenyl)-oxomethyl]amino]-2-pyrazinecarboxamide IUPAC Name: N-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-3-[(4-methylbenzoyl)amino]pyrazine-2-carboxamide Traditional Name: N-[1-(3-fluorobenzyl)-4-piperidyl]-3-(p-toluoylamino)pyrazinamide Formula: C25H26FN5O2 MolecularWeight: 447.504643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=NC=CN=C2C(=O)NC3CCN(CC3)CC4=CC(=CC=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=NC=CN=C2C(=O)NC3CCN(CC3)CC4=CC(=CC=C4)F

InChI

InChI=1S/C25H26FN5O2/c1-17-5-7-19(8-6-17)24(32)30-23-22(27-11-12-28-23)25(33)29-21-9-13-31(14-10-21)16-18-3-2-4-20(26)15-18/h2-8,11-12,15,21H,9-10,13-14,16H2,1H3,(H,29,33)(H,28,30,32)