4-[4-[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylphenyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[4-[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylphenyl]piperazine-1-carbaldehyde Openeye Name: 4-[4-[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]sulfanylphenyl]piperazine-1-carbaldehyde CAS Name: 4-[4-[[1-(2,4-dichlorophenyl)-2-(1-imidazolyl)ethyl]thio]phenyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[4-[1-(2,4-dichlorophenyl)-2-imidazol-1-ylethyl]sulfanylphenyl]piperazine-1-carbaldehyde Traditional Name: 4-[4-[[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl]thio]phenyl]piperazine-1-carbaldehyde Formula: C22H22Cl2N4OS MolecularWeight: 461.40728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C2=CC=C(C=C2)SC(CN3C=CN=C3)C4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1C=O)C2=CC=C(C=C2)SC(CN3C=CN=C3)C4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H22Cl2N4OS/c23-17-1-6-20(21(24)13-17)22(14-27-8-7-25-15-27)30-19-4-2-18(3-5-19)28-11-9-26(16-29)10-12-28/h1-8,13,15-16,22H,9-12,14H2