1-[4-[4-(1-imidazol-1-yl-4-thiophen-2-yl-butan-2-yl)sulfanylphenyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[4-(1-imidazol-1-yl-4-thiophen-2-yl-butan-2-yl)sulfanylphenyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[4-[1-(imidazol-1-ylmethyl)-3-(2-thienyl)propyl]sulfanylphenyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[4-[[1-(1-imidazolyl)-4-thiophen-2-ylbutan-2-yl]thio]phenyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[4-(1-imidazol-1-yl-4-thiophen-2-ylbutan-2-yl)sulfanylphenyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[4-[[1-(imidazol-1-ylmethyl)-3-(2-thienyl)propyl]thio]phenyl]piperazino]ethanone Formula: C23H28N4OS2 MolecularWeight: 440.62462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)SC(CCC3=CC=CS3)CN4C=CN=C4

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)SC(CCC3=CC=CS3)CN4C=CN=C4

InChI

InChI=1S/C23H28N4OS2/c1-19(28)26-12-14-27(15-13-26)20-4-6-22(7-5-20)30-23(17-25-11-10-24-18-25)9-8-21-3-2-16-29-21/h2-7,10-11,16,18,23H,8-9,12-15,17H2,1H3