2-(4-propylpiperazin-4-ium-1-yl)benzenecarbothioamide

Systemtic Name: 2-(4-propylpiperazin-4-ium-1-yl)benzenecarbothioamide Openeye Name: 2-(4-propylpiperazin-4-ium-1-yl)benzenecarbothioamide CAS Name: 2-(4-propyl-1-piperazin-4-iumyl)benzenecarbothioamide IUPAC Name: 2-(4-propylpiperazin-4-ium-1-yl)benzenecarbothioamide Traditional Name: 2-(4-propylpiperazin-4-ium-1-yl)thiobenzamide Formula: C14H22N3S+ MolecularWeight: 264.40958

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C2=CC=CC=C2C(=S)N

Isomeric SMILES

CCC[NH+]1CCN(CC1)C2=CC=CC=C2C(=S)N

InChI

InChI=1S/C14H21N3S/c1-2-7-16-8-10-17(11-9-16)13-6-4-3-5-12(13)14(15)18/h3-6H,2,7-11H2,1H3,(H2,15,18)/p+1