2-[(4-propylpiperazin-4-ium-1-yl)methyl]benzenecarbothioamide

Systemtic Name: 2-[(4-propylpiperazin-4-ium-1-yl)methyl]benzenecarbothioamide Openeye Name: 2-[(4-propylpiperazin-4-ium-1-yl)methyl]benzenecarbothioamide CAS Name: 2-[(4-propyl-1-piperazin-4-iumyl)methyl]benzenecarbothioamide IUPAC Name: 2-[(4-propylpiperazin-4-ium-1-yl)methyl]benzenecarbothioamide Traditional Name: 2-[(4-propylpiperazin-4-ium-1-yl)methyl]thiobenzamide Formula: C15H24N3S+ MolecularWeight: 278.43616

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)CC2=CC=CC=C2C(=S)N

Isomeric SMILES

CCC[NH+]1CCN(CC1)CC2=CC=CC=C2C(=S)N

InChI

InChI=1S/C15H23N3S/c1-2-7-17-8-10-18(11-9-17)12-13-5-3-4-6-14(13)15(16)19/h3-6H,2,7-12H2,1H3,(H2,16,19)/p+1