N-[2-(cyclohexylamino)-1-(4-fluorophenyl)-2-oxidanylidene-ethyl]-N-quinolin-3-yl-pyrazine-2-carboxamide

Systemtic Name: N-[2-(cyclohexylamino)-1-(4-fluorophenyl)-2-oxidanylidene-ethyl]-N-quinolin-3-yl-pyrazine-2-carboxamide Openeye Name: N-[2-(cyclohexylamino)-1-(4-fluorophenyl)-2-oxo-ethyl]-N-(3-quinolyl)pyrazine-2-carboxamide CAS Name: N-[2-(cyclohexylamino)-1-(4-fluorophenyl)-2-oxoethyl]-N-(3-quinolinyl)-2-pyrazinecarboxamide IUPAC Name: N-[2-(cyclohexylamino)-1-(4-fluorophenyl)-2-oxoethyl]-N-quinolin-3-ylpyrazine-2-carboxamide Traditional Name: N-[2-(cyclohexylamino)-1-(4-fluorophenyl)-2-keto-ethyl]-N-(3-quinolyl)pyrazinamide Formula: C28H26FN5O2 MolecularWeight: 483.536743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=C(C=C2)F)N(C3=CC4=CC=CC=C4N=C3)C(=O)C5=NC=CN=C5

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC=C(C=C2)F)N(C3=CC4=CC=CC=C4N=C3)C(=O)C5=NC=CN=C5

InChI

InChI=1S/C28H26FN5O2/c29-21-12-10-19(11-13-21)26(27(35)33-22-7-2-1-3-8-22)34(28(36)25-18-30-14-15-31-25)23-16-20-6-4-5-9-24(20)32-17-23/h4-6,9-18,22,26H,1-3,7-8H2,(H,33,35)