N-[(4-fluorophenyl)methyl]-N-[3-(hexylamino)-3-oxidanylidene-propyl]-5-methyl-pyrazine-2-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-N-[3-(hexylamino)-3-oxidanylidene-propyl]-5-methyl-pyrazine-2-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-N-[3-(hexylamino)-3-oxo-propyl]-5-methyl-pyrazine-2-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-N-[3-(hexylamino)-3-oxopropyl]-5-methyl-2-pyrazinecarboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-N-[3-(hexylamino)-3-oxopropyl]-5-methylpyrazine-2-carboxamide Traditional Name: N-(4-fluorobenzyl)-N-[3-(hexylamino)-3-keto-propyl]-5-methyl-pyrazinamide Formula: C22H29FN4O2 MolecularWeight: 400.489663

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CCN(CC1=CC=C(C=C1)F)C(=O)C2=CN=C(C=N2)C

Isomeric SMILES

CCCCCCNC(=O)CCN(CC1=CC=C(C=C1)F)C(=O)C2=CN=C(C=N2)C

InChI

InChI=1S/C22H29FN4O2/c1-3-4-5-6-12-24-21(28)11-13-27(16-18-7-9-19(23)10-8-18)22(29)20-15-25-17(2)14-26-20/h7-10,14-15H,3-6,11-13,16H2,1-2H3,(H,24,28)