N-butyl-4-methylsulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-butyl-4-methylsulfonyl-piperazine-1-carbothioamide Openeye Name: N-butyl-4-methylsulfonyl-piperazine-1-carbothioamide CAS Name: N-butyl-4-methylsulfonyl-1-piperazinecarbothioamide IUPAC Name: N-butyl-4-methylsulfonylpiperazine-1-carbothioamide Traditional Name: N-butyl-4-mesyl-piperazine-1-carbothioamide Formula: C10H21N3O2S2 MolecularWeight: 279.42264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N1CCN(CC1)S(=O)(=O)C

Isomeric SMILES

CCCCNC(=S)N1CCN(CC1)S(=O)(=O)C

InChI

InChI=1S/C10H21N3O2S2/c1-3-4-5-11-10(16)12-6-8-13(9-7-12)17(2,14)15/h3-9H2,1-2H3,(H,11,16)