4-(4-phenylpiperazin-1-ium-1-yl)butanethioamide

Systemtic Name: 4-(4-phenylpiperazin-1-ium-1-yl)butanethioamide Openeye Name: 4-(4-phenylpiperazin-1-ium-1-yl)butanethioamide CAS Name: 4-(4-phenyl-1-piperazin-1-iumyl)butanethioamide IUPAC Name: 4-(4-phenylpiperazin-1-ium-1-yl)butanethioamide Traditional Name: 4-(4-phenylpiperazin-1-ium-1-yl)thiobutyramide Formula: C14H22N3S+ MolecularWeight: 264.40958

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC(=S)N)C2=CC=CC=C2

Isomeric SMILES

C1CN(CC[NH+]1CCCC(=S)N)C2=CC=CC=C2

InChI

InChI=1S/C14H21N3S/c15-14(18)7-4-8-16-9-11-17(12-10-16)13-5-2-1-3-6-13/h1-3,5-6H,4,7-12H2,(H2,15,18)/p+1