6-methyl-2-[2-(4-propan-2-ylpiperazin-4-ium-1-yl)ethylamino]pyridine-3-carbonitrile

Systemtic Name: 6-methyl-2-[2-(4-propan-2-ylpiperazin-4-ium-1-yl)ethylamino]pyridine-3-carbonitrile Openeye Name: 2-[2-(4-isopropylpiperazin-4-ium-1-yl)ethylamino]-6-methyl-pyridine-3-carbonitrile CAS Name: 6-methyl-2-[2-(4-propan-2-yl-1-piperazin-4-iumyl)ethylamino]-3-pyridinecarbonitrile IUPAC Name: 6-methyl-2-[2-(4-propan-2-ylpiperazin-4-ium-1-yl)ethylamino]pyridine-3-carbonitrile Traditional Name: 2-[2-(4-isopropylpiperazin-4-ium-1-yl)ethylamino]-6-methyl-nicotinonitrile Formula: C16H26N5+ MolecularWeight: 288.41114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C#N)NCCN2CC[NH+](CC2)C(C)C

Isomeric SMILES

CC1=NC(=C(C=C1)C#N)NCCN2CC[NH+](CC2)C(C)C

InChI

InChI=1S/C16H25N5/c1-13(2)21-10-8-20(9-11-21)7-6-18-16-15(12-17)5-4-14(3)19-16/h4-5,13H,6-11H2,1-3H3,(H,18,19)/p+1