2-[4-(3-thiophen-3-ylpropanoyl)piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-(3-thiophen-3-ylpropanoyl)piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[3-(3-thienyl)propanoyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[1-oxo-3-(3-thiophenyl)propyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-(3-thiophen-3-ylpropanoyl)piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[3-(3-thienyl)propanoyl]piperazino]isonicotinonitrile Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)CCC3=CSC=C3

Isomeric SMILES

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)CCC3=CSC=C3

InChI

InChI=1S/C17H18N4OS/c18-12-15-3-5-19-16(11-15)20-6-8-21(9-7-20)17(22)2-1-14-4-10-23-13-14/h3-5,10-11,13H,1-2,6-9H2