4-(phenylsulfonyl)-N-propyl-piperazine-1-carbothioamide

Systemtic Name: 4-(phenylsulfonyl)-N-propyl-piperazine-1-carbothioamide Openeye Name: 4-(benzenesulfonyl)-N-propyl-piperazine-1-carbothioamide CAS Name: 4-(benzenesulfonyl)-N-propyl-1-piperazinecarbothioamide IUPAC Name: 4-(benzenesulfonyl)-N-propylpiperazine-1-carbothioamide Traditional Name: 4-besyl-N-propyl-piperazine-1-carbothioamide Formula: C14H21N3O2S2 MolecularWeight: 327.46544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O2S2/c1-2-8-15-14(20)16-9-11-17(12-10-16)21(18,19)13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3,(H,15,20)