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

Systemtic Name: 4-(4-tert-butylphenyl)sulfonyl-N-[3-(dimethylamino)propyl]piperazine-1-carbothioamide Openeye Name: 4-(4-tert-butylphenyl)sulfonyl-N-[3-(dimethylamino)propyl]piperazine-1-carbothioamide CAS Name: 4-(4-tert-butylphenyl)sulfonyl-N-[3-(dimethylamino)propyl]-1-piperazinecarbothioamide IUPAC Name: 4-(4-tert-butylphenyl)sulfonyl-N-[3-(dimethylamino)propyl]piperazine-1-carbothioamide Traditional Name: 4-(4-tert-butylphenyl)sulfonyl-N-[3-(dimethylamino)propyl]piperazine-1-carbothioamide Formula: C20H34N4O2S2 MolecularWeight: 426.63956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H34N4O2S2/c1-20(2,3)17-7-9-18(10-8-17)28(25,26)24-15-13-23(14-16-24)19(27)21-11-6-12-22(4)5/h7-10H,6,11-16H2,1-5H3,(H,21,27)