N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-methyl-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide

Systemtic Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-methyl-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide Openeye Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-methyl-N-(3-pyridylmethyl)pyrazine-2-carboxamide CAS Name: N-[[(3R)-1-cyclohexyl-3-piperidin-1-iumyl]methyl]-5-methyl-N-(3-pyridinylmethyl)-2-pyrazinecarboxamide IUPAC Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-methyl-N-(pyridin-3-ylmethyl)pyrazine-2-carboxamide Traditional Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-methyl-N-(3-pyridylmethyl)pyrazinamide Formula: C24H34N5O+ MolecularWeight: 408.55966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N(CC2CCC[NH+](C2)C3CCCCC3)CC4=CN=CC=C4

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N(C[C@H]2CCC[NH+](C2)C3CCCCC3)CC4=CN=CC=C4

InChI

InChI=1S/C24H33N5O/c1-19-13-27-23(15-26-19)24(30)29(16-20-7-5-11-25-14-20)18-21-8-6-12-28(17-21)22-9-3-2-4-10-22/h5,7,11,13-15,21-22H,2-4,6,8-10,12,16-18H2,1H3/p+1/t21-/m0/s1