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

Systemtic Name: N-[3-(hexylamino)-3-oxidanylidene-propyl]-5-methyl-N-(2-morpholin-4-ium-4-ylethyl)pyrazine-2-carboxamide Openeye Name: N-[3-(hexylamino)-3-oxo-propyl]-5-methyl-N-(2-morpholin-4-ium-4-ylethyl)pyrazine-2-carboxamide CAS Name: N-[3-(hexylamino)-3-oxopropyl]-5-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-(hexylamino)-3-oxopropyl]-5-methyl-N-(2-morpholin-4-ium-4-ylethyl)pyrazine-2-carboxamide Traditional Name: N-[3-(hexylamino)-3-keto-propyl]-5-methyl-N-(2-morpholin-4-ium-4-ylethyl)pyrazinamide Formula: C21H36N5O3+ MolecularWeight: 406.54224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CCN(CC[NH+]1CCOCC1)C(=O)C2=CN=C(C=N2)C

Isomeric SMILES

CCCCCCNC(=O)CCN(CC[NH+]1CCOCC1)C(=O)C2=CN=C(C=N2)C

InChI

InChI=1S/C21H35N5O3/c1-3-4-5-6-8-22-20(27)7-9-26(11-10-25-12-14-29-15-13-25)21(28)19-17-23-18(2)16-24-19/h16-17H,3-15H2,1-2H3,(H,22,27)/p+1