4-(4-chlorophenyl)sulfonyl-N-(2,4,5-trimethylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-chlorophenyl)sulfonyl-N-(2,4,5-trimethylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-chlorophenyl)sulfonyl-N-(2,4,5-trimethylphenyl)piperazine-1-carbothioamide CAS Name: 4-(4-chlorophenyl)sulfonyl-N-(2,4,5-trimethylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-chlorophenyl)sulfonyl-N-(2,4,5-trimethylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-chlorophenyl)sulfonyl-N-(2,4,5-trimethylphenyl)piperazine-1-carbothioamide Formula: C20H24ClN3O2S2 MolecularWeight: 438.00646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1C)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C20H24ClN3O2S2/c1-14-12-16(3)19(13-15(14)2)22-20(27)23-8-10-24(11-9-23)28(25,26)18-6-4-17(21)5-7-18/h4-7,12-13H,8-11H2,1-3H3,(H,22,27)