6-[[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]amino]pyridine-3-carbonitrile

Systemtic Name: 6-[[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]amino]pyridine-3-carbonitrile Openeye Name: 6-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-anilino]pyridine-3-carbonitrile CAS Name: 6-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylanilino]-3-pyridinecarbonitrile IUPAC Name: 6-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylanilino]pyridine-3-carbonitrile Traditional Name: 6-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-anilino]nicotinonitrile Formula: C19H24N5+ MolecularWeight: 322.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC3=NC=C(C=C3)C#N)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)NC3=NC=C(C=C3)C#N)C

InChI

InChI=1S/C19H23N5/c1-3-23-8-10-24(11-9-23)18-6-5-17(12-15(18)2)22-19-7-4-16(13-20)14-21-19/h4-7,12,14H,3,8-11H2,1-2H3,(H,21,22)/p+1