N-[3-[(4-fluorophenyl)methylamino]-3-oxidanylidene-propyl]-N-phenethyl-pyrazine-2-carboxamide

Systemtic Name: N-[3-[(4-fluorophenyl)methylamino]-3-oxidanylidene-propyl]-N-phenethyl-pyrazine-2-carboxamide Openeye Name: N-[3-[(4-fluorophenyl)methylamino]-3-oxo-propyl]-N-phenethyl-pyrazine-2-carboxamide CAS Name: N-[3-[(4-fluorophenyl)methylamino]-3-oxopropyl]-N-phenethyl-2-pyrazinecarboxamide IUPAC Name: N-[3-[(4-fluorophenyl)methylamino]-3-oxopropyl]-N-phenethylpyrazine-2-carboxamide Traditional Name: N-[3-[(4-fluorobenzyl)amino]-3-keto-propyl]-N-phenethyl-pyrazinamide Formula: C23H23FN4O2 MolecularWeight: 406.452723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CCC(=O)NCC2=CC=C(C=C2)F)C(=O)C3=NC=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)CCN(CCC(=O)NCC2=CC=C(C=C2)F)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C23H23FN4O2/c24-20-8-6-19(7-9-20)16-27-22(29)11-15-28(14-10-18-4-2-1-3-5-18)23(30)21-17-25-12-13-26-21/h1-9,12-13,17H,10-11,14-16H2,(H,27,29)