N-(3,5-dimethylphenyl)-N-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]pyrazine-2-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-N-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]pyrazine-2-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-N-[2-(4-fluoroanilino)-2-oxo-1-phenyl-ethyl]pyrazine-2-carboxamide CAS Name: N-(3,5-dimethylphenyl)-N-[2-(4-fluoroanilino)-2-oxo-1-phenylethyl]-2-pyrazinecarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-N-[2-(4-fluoroanilino)-2-oxo-1-phenylethyl]pyrazine-2-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-N-[2-(4-fluoroanilino)-2-keto-1-phenyl-ethyl]pyrazinamide Formula: C27H23FN4O2 MolecularWeight: 454.495523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N(C(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F)C(=O)C4=NC=CN=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)N(C(C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)F)C(=O)C4=NC=CN=C4)C

InChI

InChI=1S/C27H23FN4O2/c1-18-14-19(2)16-23(15-18)32(27(34)24-17-29-12-13-30-24)25(20-6-4-3-5-7-20)26(33)31-22-10-8-21(28)9-11-22/h3-17,25H,1-2H3,(H,31,33)