N-[3-(dimethylamino)propyl]-4-(phenylsulfonyl)piperazine-1-carbothioamide

Systemtic Name: N-[3-(dimethylamino)propyl]-4-(phenylsulfonyl)piperazine-1-carbothioamide Openeye Name: 4-(benzenesulfonyl)-N-[3-(dimethylamino)propyl]piperazine-1-carbothioamide CAS Name: 4-(benzenesulfonyl)-N-[3-(dimethylamino)propyl]-1-piperazinecarbothioamide IUPAC Name: 4-(benzenesulfonyl)-N-[3-(dimethylamino)propyl]piperazine-1-carbothioamide Traditional Name: 4-besyl-N-[3-(dimethylamino)propyl]piperazine-1-carbothioamide Formula: C16H26N4O2S2 MolecularWeight: 370.53324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N4O2S2/c1-18(2)10-6-9-17-16(23)19-11-13-20(14-12-19)24(21,22)15-7-4-3-5-8-15/h3-5,7-8H,6,9-14H2,1-2H3,(H,17,23)