3-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbothioylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbothioylamino]propyl-dimethyl-azanium Openeye Name: 3-[[4-(1,3-benzothiazol-2-yl)piperidine-1-carbothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[4-(1,3-benzothiazol-2-yl)piperidine-1-carbothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[4-(1,3-benzothiazol-2-yl)piperidine-1-carbothioyl]amino]propyl-dimethyl-ammonium Formula: C18H27N4S2+ MolecularWeight: 363.56378

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC(=S)N1CCC(CC1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

C[NH+](C)CCCNC(=S)N1CCC(CC1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H26N4S2/c1-21(2)11-5-10-19-18(23)22-12-8-14(9-13-22)17-20-15-6-3-4-7-16(15)24-17/h3-4,6-7,14H,5,8-13H2,1-2H3,(H,19,23)/p+1