5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-N-[3-oxidanylidene-3-[(phenylmethyl)amino]propyl]pyrazine-2-carboxamide

Systemtic Name: 5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-N-[3-oxidanylidene-3-[(phenylmethyl)amino]propyl]pyrazine-2-carboxamide Openeye Name: N-[3-(benzylamino)-3-oxo-propyl]-5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)pyrazine-2-carboxamide CAS Name: 5-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-N-[3-oxo-3-[(phenylmethyl)amino]propyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-(benzylamino)-3-oxopropyl]-5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)pyrazine-2-carboxamide Traditional Name: N-[3-(benzylamino)-3-keto-propyl]-5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)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[NH+]2CCOCC2)CCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N(CCC[NH+]2CCOCC2)CCC(=O)NCC3=CC=CC=C3

InChI

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