4-(1,3-benzothiazol-2-ylmethyl)-N-methyl-piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-methyl-piperazin-4-ium-1-carbothioamide Openeye Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-methyl-piperazin-4-ium-1-carbothioamide CAS Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-methyl-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-methylpiperazin-4-ium-1-carbothioamide Traditional Name: 4-(1,3-benzothiazol-2-ylmethyl)-N-methyl-piperazin-4-ium-1-carbothioamide Formula: C14H19N4S2+ MolecularWeight: 307.45746

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1CC[NH+](CC1)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CNC(=S)N1CC[NH+](CC1)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H18N4S2/c1-15-14(19)18-8-6-17(7-9-18)10-13-16-11-4-2-3-5-12(11)20-13/h2-5H,6-10H2,1H3,(H,15,19)/p+1