1-(3-chlorophenyl)-3-[[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methyl]imidazole-2-thione

Systemtic Name: 1-(3-chlorophenyl)-3-[[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methyl]imidazole-2-thione Openeye Name: 1-(3-chlorophenyl)-3-[[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methyl]imidazole-2-thione CAS Name: 1-(3-chlorophenyl)-3-[[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]methyl]-2-imidazolethione IUPAC Name: 1-(3-chlorophenyl)-3-[[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methyl]imidazole-2-thione Traditional Name: 1-(3-chlorophenyl)-3-[[4-(2-nitrophenyl)sulfonylpiperazino]methyl]-4-imidazoline-2-thione Formula: C20H20ClN5O4S2 MolecularWeight: 493.9869

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C=CN(C2=S)C3=CC(=CC=C3)Cl)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CN2C=CN(C2=S)C3=CC(=CC=C3)Cl)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN5O4S2/c21-16-4-3-5-17(14-16)25-13-10-23(20(25)31)15-22-8-11-24(12-9-22)32(29,30)19-7-2-1-6-18(19)26(27)28/h1-7,10,13-14H,8-9,11-12,15H2