N-(3-methylsulfanylpropyl)-4-(phenylsulfonyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-methylsulfanylpropyl)-4-(phenylsulfonyl)piperazine-1-carbothioamide Openeye Name: 4-(benzenesulfonyl)-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide CAS Name: 4-(benzenesulfonyl)-N-[3-(methylthio)propyl]-1-piperazinecarbothioamide IUPAC Name: 4-(benzenesulfonyl)-N-(3-methylsulfanylpropyl)piperazine-1-carbothioamide Traditional Name: 4-besyl-N-[3-(methylthio)propyl]piperazine-1-carbothioamide Formula: C15H23N3O2S3 MolecularWeight: 373.55702

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CSCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H23N3O2S3/c1-22-13-5-8-16-15(21)17-9-11-18(12-10-17)23(19,20)14-6-3-2-4-7-14/h2-4,6-7H,5,8-13H2,1H3,(H,16,21)