N-[3-(dimethylamino)propyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-[3-(dimethylamino)propyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-[3-(dimethylamino)propyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-[3-(dimethylamino)propyl]-4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-[3-(dimethylamino)propyl]-4-(2,4,6-trimethylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-[3-(dimethylamino)propyl]-4-mesitylsulfonyl-piperazine-1-carbothioamide Formula: C19H32N4O2S2 MolecularWeight: 412.61298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H32N4O2S2/c1-15-13-16(2)18(17(3)14-15)27(24,25)23-11-9-22(10-12-23)19(26)20-7-6-8-21(4)5/h13-14H,6-12H2,1-5H3,(H,20,26)