[1-[4-(pyrazin-2-ylcarbonylamino)phenyl]piperidin-4-yl]-(3-pyridin-3-ylpropyl)azanium

Systemtic Name: [1-[4-(pyrazin-2-ylcarbonylamino)phenyl]piperidin-4-yl]-(3-pyridin-3-ylpropyl)azanium Openeye Name: [1-[4-(pyrazine-2-carbonylamino)phenyl]-4-piperidyl]-[3-(3-pyridyl)propyl]ammonium CAS Name: [1-[4-[[oxo(2-pyrazinyl)methyl]amino]phenyl]-4-piperidinyl]-[3-(3-pyridinyl)propyl]ammonium IUPAC Name: [1-[4-(pyrazine-2-carbonylamino)phenyl]piperidin-4-yl]-(3-pyridin-3-ylpropyl)azanium Traditional Name: [1-[4-(pyrazinoylamino)phenyl]-4-piperidyl]-[3-(3-pyridyl)propyl]ammonium Formula: C24H29N6O+ MolecularWeight: 417.52666

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH2+]CCCC2=CN=CC=C2)C3=CC=C(C=C3)NC(=O)C4=NC=CN=C4

Isomeric SMILES

C1CN(CCC1[NH2+]CCCC2=CN=CC=C2)C3=CC=C(C=C3)NC(=O)C4=NC=CN=C4

InChI

InChI=1S/C24H28N6O/c31-24(23-18-26-13-14-28-23)29-21-5-7-22(8-6-21)30-15-9-20(10-16-30)27-12-2-4-19-3-1-11-25-17-19/h1,3,5-8,11,13-14,17-18,20,27H,2,4,9-10,12,15-16H2,(H,29,31)/p+1