N-[3-[[(2S)-butan-2-yl]amino]-3-oxidanylidene-propyl]-5-methyl-N-(2-piperidin-1-ium-1-ylethyl)pyrazine-2-carboxamide

Systemtic Name: N-[3-[[(2S)-butan-2-yl]amino]-3-oxidanylidene-propyl]-5-methyl-N-(2-piperidin-1-ium-1-ylethyl)pyrazine-2-carboxamide Openeye Name: 5-methyl-N-[3-[[(1S)-1-methylpropyl]amino]-3-oxo-propyl]-N-(2-piperidin-1-ium-1-ylethyl)pyrazine-2-carboxamide CAS Name: N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methyl-N-[2-(1-piperidin-1-iumyl)ethyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-5-methyl-N-(2-piperidin-1-ium-1-ylethyl)pyrazine-2-carboxamide Traditional Name: N-[3-keto-3-[[(1S)-1-methylpropyl]amino]propyl]-5-methyl-N-(2-piperidin-1-ium-1-ylethyl)pyrazinamide Formula: C20H34N5O2+ MolecularWeight: 376.51626

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CCN(CC[NH+]1CCCCC1)C(=O)C2=CN=C(C=N2)C

Isomeric SMILES

CC[C@H](C)NC(=O)CCN(CC[NH+]1CCCCC1)C(=O)C2=CN=C(C=N2)C

InChI

InChI=1S/C20H33N5O2/c1-4-16(2)23-19(26)8-11-25(13-12-24-9-6-5-7-10-24)20(27)18-15-21-17(3)14-22-18/h14-16H,4-13H2,1-3H3,(H,23,26)/p+1/t16-/m0/s1