2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-ethanone CAS Name: 2-[[1-(3-chlorophenyl)-2-imidazolyl]thio]-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanylethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-[[1-(3-chlorophenyl)imidazol-2-yl]thio]ethanone Formula: C22H23ClN4O3S2 MolecularWeight: 491.02602

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=NC=CN2C3=CC(=CC=C3)Cl)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=NC=CN2C3=CC(=CC=C3)Cl)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4O3S2/c23-19-7-4-8-20(15-19)27-10-9-24-22(27)31-16-21(28)25-11-13-26(14-12-25)32(29,30)17-18-5-2-1-3-6-18/h1-10,15H,11-14,16-17H2