N-[3-(2-methylpropylamino)-3-oxidanylidene-propyl]-N-(2-piperidin-1-ium-1-ylethyl)pyrazine-2-carboxamide

Systemtic Name: N-[3-(2-methylpropylamino)-3-oxidanylidene-propyl]-N-(2-piperidin-1-ium-1-ylethyl)pyrazine-2-carboxamide Openeye Name: N-[3-(isobutylamino)-3-oxo-propyl]-N-(2-piperidin-1-ium-1-ylethyl)pyrazine-2-carboxamide CAS Name: N-[3-(2-methylpropylamino)-3-oxopropyl]-N-[2-(1-piperidin-1-iumyl)ethyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-(2-methylpropylamino)-3-oxopropyl]-N-(2-piperidin-1-ium-1-ylethyl)pyrazine-2-carboxamide Traditional Name: N-[3-(isobutylamino)-3-keto-propyl]-N-(2-piperidin-1-ium-1-ylethyl)pyrazinamide Formula: C19H32N5O2+ MolecularWeight: 362.48968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CCN(CC[NH+]1CCCCC1)C(=O)C2=NC=CN=C2

Isomeric SMILES

CC(C)CNC(=O)CCN(CC[NH+]1CCCCC1)C(=O)C2=NC=CN=C2

InChI

InChI=1S/C19H31N5O2/c1-16(2)14-22-18(25)6-11-24(13-12-23-9-4-3-5-10-23)19(26)17-15-20-7-8-21-17/h7-8,15-16H,3-6,9-14H2,1-2H3,(H,22,25)/p+1