4-(1,2-benzothiazol-3-yl)-N-methyl-piperazine-1-carbothioamide

Systemtic Name: 4-(1,2-benzothiazol-3-yl)-N-methyl-piperazine-1-carbothioamide Openeye Name: 4-(1,2-benzothiazol-3-yl)-N-methyl-piperazine-1-carbothioamide CAS Name: 4-(1,2-benzothiazol-3-yl)-N-methyl-1-piperazinecarbothioamide IUPAC Name: 4-(1,2-benzothiazol-3-yl)-N-methylpiperazine-1-carbothioamide Traditional Name: 4-(1,2-benzothiazol-3-yl)-N-methyl-piperazine-1-carbothioamide Formula: C13H16N4S2 MolecularWeight: 292.42294

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1CCN(CC1)C2=NSC3=CC=CC=C32

Isomeric SMILES

CNC(=S)N1CCN(CC1)C2=NSC3=CC=CC=C32

InChI

InChI=1S/C13H16N4S2/c1-14-13(18)17-8-6-16(7-9-17)12-10-4-2-3-5-11(10)19-15-12/h2-5H,6-9H2,1H3,(H,14,18)