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

Systemtic Name: N-[2-(cyclohexylamino)-1-(4-fluorophenyl)-2-oxidanylidene-ethyl]-N-(3-ethanoylphenyl)pyrazine-2-carboxamide Openeye Name: N-(3-acetylphenyl)-N-[2-(cyclohexylamino)-1-(4-fluorophenyl)-2-oxo-ethyl]pyrazine-2-carboxamide CAS Name: N-(3-acetylphenyl)-N-[2-(cyclohexylamino)-1-(4-fluorophenyl)-2-oxoethyl]-2-pyrazinecarboxamide IUPAC Name: N-(3-acetylphenyl)-N-[2-(cyclohexylamino)-1-(4-fluorophenyl)-2-oxoethyl]pyrazine-2-carboxamide Traditional Name: N-(3-acetylphenyl)-N-[2-(cyclohexylamino)-1-(4-fluorophenyl)-2-keto-ethyl]pyrazinamide Formula: C27H27FN4O3 MolecularWeight: 474.526683

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N(C(C2=CC=C(C=C2)F)C(=O)NC3CCCCC3)C(=O)C4=NC=CN=C4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N(C(C2=CC=C(C=C2)F)C(=O)NC3CCCCC3)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C27H27FN4O3/c1-18(33)20-6-5-9-23(16-20)32(27(35)24-17-29-14-15-30-24)25(19-10-12-21(28)13-11-19)26(34)31-22-7-3-2-4-8-22/h5-6,9-17,22,25H,2-4,7-8H2,1H3,(H,31,34)