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

Systemtic Name: 5-methyl-N-(2-morpholin-4-ium-4-ylethyl)-N-[3-oxidanylidene-3-(phenethylamino)propyl]pyrazine-2-carboxamide Openeye Name: 5-methyl-N-(2-morpholin-4-ium-4-ylethyl)-N-[3-oxo-3-(phenethylamino)propyl]pyrazine-2-carboxamide CAS Name: 5-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]-N-[3-oxo-3-(phenethylamino)propyl]-2-pyrazinecarboxamide IUPAC Name: 5-methyl-N-(2-morpholin-4-ium-4-ylethyl)-N-[3-oxo-3-(phenethylamino)propyl]pyrazine-2-carboxamide Traditional Name: N-[3-keto-3-(phenethylamino)propyl]-5-methyl-N-(2-morpholin-4-ium-4-ylethyl)pyrazinamide Formula: C23H32N5O3+ MolecularWeight: 426.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N(CCC(=O)NCCC2=CC=CC=C2)CC[NH+]3CCOCC3

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N(CCC(=O)NCCC2=CC=CC=C2)CC[NH+]3CCOCC3

InChI

InChI=1S/C23H31N5O3/c1-19-17-26-21(18-25-19)23(30)28(12-11-27-13-15-31-16-14-27)10-8-22(29)24-9-7-20-5-3-2-4-6-20/h2-6,17-18H,7-16H2,1H3,(H,24,29)/p+1