4-(4-chlorophenyl)sulfonyl-N-[(2,4-dichlorophenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: 4-(4-chlorophenyl)sulfonyl-N-[(2,4-dichlorophenyl)methyl]piperazine-1-carbothioamide Openeye Name: 4-(4-chlorophenyl)sulfonyl-N-[(2,4-dichlorophenyl)methyl]piperazine-1-carbothioamide CAS Name: 4-(4-chlorophenyl)sulfonyl-N-[(2,4-dichlorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: 4-(4-chlorophenyl)sulfonyl-N-[(2,4-dichlorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: 4-(4-chlorophenyl)sulfonyl-N-(2,4-dichlorobenzyl)piperazine-1-carbothioamide Formula: C18H18Cl3N3O2S2 MolecularWeight: 478.84342

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=S)NCC2=C(C=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C(=S)NCC2=C(C=C(C=C2)Cl)Cl)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H18Cl3N3O2S2/c19-14-3-5-16(6-4-14)28(25,26)24-9-7-23(8-10-24)18(27)22-12-13-1-2-15(20)11-17(13)21/h1-6,11H,7-10,12H2,(H,22,27)