4-(4-pyridin-2-ylpiperazin-1-yl)butanethioamide

Systemtic Name: 4-(4-pyridin-2-ylpiperazin-1-yl)butanethioamide Openeye Name: 4-[4-(2-pyridyl)piperazin-1-yl]butanethioamide CAS Name: 4-[4-(2-pyridinyl)-1-piperazinyl]butanethioamide IUPAC Name: 4-(4-pyridin-2-ylpiperazin-1-yl)butanethioamide Traditional Name: 4-[4-(2-pyridyl)piperazino]thiobutyramide Formula: C13H20N4S MolecularWeight: 264.3897

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(=S)N)C2=CC=CC=N2

Isomeric SMILES

C1CN(CCN1CCCC(=S)N)C2=CC=CC=N2

InChI

InChI=1S/C13H20N4S/c14-12(18)4-3-7-16-8-10-17(11-9-16)13-5-1-2-6-15-13/h1-2,5-6H,3-4,7-11H2,(H2,14,18)