5-(6-piperazin-4-ium-1-ylpyridin-2-yl)thiophene-2-carbonitrile

Systemtic Name: 5-(6-piperazin-4-ium-1-ylpyridin-2-yl)thiophene-2-carbonitrile Openeye Name: 5-(6-piperazin-4-ium-1-yl-2-pyridyl)thiophene-2-carbonitrile CAS Name: 5-[6-(1-piperazin-4-iumyl)-2-pyridinyl]-2-thiophenecarbonitrile IUPAC Name: 5-(6-piperazin-4-ium-1-ylpyridin-2-yl)thiophene-2-carbonitrile Traditional Name: 5-(6-piperazin-4-ium-1-yl-2-pyridyl)thiophene-2-carbonitrile Formula: C14H15N4S+ MolecularWeight: 271.3607

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=CC=CC(=N2)C3=CC=C(S3)C#N

Isomeric SMILES

C1CN(CC[NH2+]1)C2=CC=CC(=N2)C3=CC=C(S3)C#N

InChI

InChI=1S/C14H14N4S/c15-10-11-4-5-13(19-11)12-2-1-3-14(17-12)18-8-6-16-7-9-18/h1-5,16H,6-9H2/p+1