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

Systemtic Name: N-[3-[(4-fluorophenyl)methylamino]-3-oxidanylidene-propyl]-N-(phenylmethyl)pyrazine-2-carboxamide Openeye Name: N-benzyl-N-[3-[(4-fluorophenyl)methylamino]-3-oxo-propyl]pyrazine-2-carboxamide CAS Name: N-[3-[(4-fluorophenyl)methylamino]-3-oxopropyl]-N-(phenylmethyl)-2-pyrazinecarboxamide IUPAC Name: N-benzyl-N-[3-[(4-fluorophenyl)methylamino]-3-oxopropyl]pyrazine-2-carboxamide Traditional Name: N-benzyl-N-[3-[(4-fluorobenzyl)amino]-3-keto-propyl]pyrazinamide Formula: C22H21FN4O2 MolecularWeight: 392.426143

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21FN4O2/c23-19-8-6-17(7-9-19)14-26-21(28)10-13-27(16-18-4-2-1-3-5-18)22(29)20-15-24-11-12-25-20/h1-9,11-12,15H,10,13-14,16H2,(H,26,28)