4-[4-[4-(5-chloranylthiophen-2-yl)-1-imidazol-1-yl-butan-2-yl]sulfanylphenyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[4-[4-(5-chloranylthiophen-2-yl)-1-imidazol-1-yl-butan-2-yl]sulfanylphenyl]piperazine-1-carbaldehyde Openeye Name: 4-[4-[3-(5-chloro-2-thienyl)-1-(imidazol-1-ylmethyl)propyl]sulfanylphenyl]piperazine-1-carbaldehyde CAS Name: 4-[4-[[4-(5-chloro-2-thiophenyl)-1-(1-imidazolyl)butan-2-yl]thio]phenyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[4-[4-(5-chlorothiophen-2-yl)-1-imidazol-1-ylbutan-2-yl]sulfanylphenyl]piperazine-1-carbaldehyde Traditional Name: 4-[4-[[3-(5-chloro-2-thienyl)-1-(imidazol-1-ylmethyl)propyl]thio]phenyl]piperazine-1-carbaldehyde Formula: C22H25ClN4OS2 MolecularWeight: 461.0431

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C2=CC=C(C=C2)SC(CCC3=CC=C(S3)Cl)CN4C=CN=C4

Isomeric SMILES

C1CN(CCN1C=O)C2=CC=C(C=C2)SC(CCC3=CC=C(S3)Cl)CN4C=CN=C4

InChI

InChI=1S/C22H25ClN4OS2/c23-22-8-7-20(30-22)5-6-21(15-26-10-9-24-16-26)29-19-3-1-18(2-4-19)27-13-11-25(17-28)12-14-27/h1-4,7-10,16-17,21H,5-6,11-15H2