N-(4-fluorophenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]-1-pyridin-3-yl-ethyl]pyrazine-2-carboxamide

Systemtic Name: N-(4-fluorophenyl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]-1-pyridin-3-yl-ethyl]pyrazine-2-carboxamide Openeye Name: N-[2-(benzylamino)-2-oxo-1-(3-pyridyl)ethyl]-N-(4-fluorophenyl)pyrazine-2-carboxamide CAS Name: N-(4-fluorophenyl)-N-[2-oxo-2-[(phenylmethyl)amino]-1-(3-pyridinyl)ethyl]-2-pyrazinecarboxamide IUPAC Name: N-[2-(benzylamino)-2-oxo-1-pyridin-3-ylethyl]-N-(4-fluorophenyl)pyrazine-2-carboxamide Traditional Name: N-[2-(benzylamino)-2-keto-1-(3-pyridyl)ethyl]-N-(4-fluorophenyl)pyrazinamide Formula: C25H20FN5O2 MolecularWeight: 441.457003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(C2=CN=CC=C2)N(C3=CC=C(C=C3)F)C(=O)C4=NC=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(C2=CN=CC=C2)N(C3=CC=C(C=C3)F)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C25H20FN5O2/c26-20-8-10-21(11-9-20)31(25(33)22-17-28-13-14-29-22)23(19-7-4-12-27-16-19)24(32)30-15-18-5-2-1-3-6-18/h1-14,16-17,23H,15H2,(H,30,32)