4-methylsulfonyl-N-phenyl-piperazine-1-carbothioamide

Systemtic Name: 4-methylsulfonyl-N-phenyl-piperazine-1-carbothioamide Openeye Name: 4-methylsulfonyl-N-phenyl-piperazine-1-carbothioamide CAS Name: 4-methylsulfonyl-N-phenyl-1-piperazinecarbothioamide IUPAC Name: 4-methylsulfonyl-N-phenylpiperazine-1-carbothioamide Traditional Name: 4-mesyl-N-phenyl-piperazine-1-carbothioamide Formula: C12H17N3O2S2 MolecularWeight: 299.41228

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=S)NC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=S)NC2=CC=CC=C2

InChI

InChI=1S/C12H17N3O2S2/c1-19(16,17)15-9-7-14(8-10-15)12(18)13-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H,13,18)