N-[(4-chlorophenyl)methyl]-4-(4-fluorophenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-(4-fluorophenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-[(4-chlorophenyl)methyl]-4-(4-fluorophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-[(4-chlorophenyl)methyl]-4-(4-fluorophenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-[(4-chlorophenyl)methyl]-4-(4-fluorophenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-(4-chlorobenzyl)-4-(4-fluorophenyl)sulfonyl-piperazine-1-carbothioamide Formula: C18H19ClFN3O2S2 MolecularWeight: 427.943763

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClFN3O2S2/c19-15-3-1-14(2-4-15)13-21-18(26)22-9-11-23(12-10-22)27(24,25)17-7-5-16(20)6-8-17/h1-8H,9-13H2,(H,21,26)