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

Systemtic Name: N-[3-(dimethylamino)propyl]-4-(4-methylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-[3-(dimethylamino)propyl]-4-(p-tolylsulfonyl)piperazine-1-carbothioamide CAS Name: N-[3-(dimethylamino)propyl]-4-(4-methylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-[3-(dimethylamino)propyl]-4-(4-methylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-[3-(dimethylamino)propyl]-4-tosyl-piperazine-1-carbothioamide Formula: C17H28N4O2S2 MolecularWeight: 384.55982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCCCN(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCCCN(C)C

InChI

InChI=1S/C17H28N4O2S2/c1-15-5-7-16(8-6-15)25(22,23)21-13-11-20(12-14-21)17(24)18-9-4-10-19(2)3/h5-8H,4,9-14H2,1-3H3,(H,18,24)