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

Systemtic Name: 1-[4-[4-(1-imidazol-1-yl-4-pyridin-4-yl-butan-2-yl)sulfanylphenyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[4-[1-(imidazol-1-ylmethyl)-3-(4-pyridyl)propyl]sulfanylphenyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[4-[[1-(1-imidazolyl)-4-pyridin-4-ylbutan-2-yl]thio]phenyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[4-(1-imidazol-1-yl-4-pyridin-4-ylbutan-2-yl)sulfanylphenyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[4-[[1-(imidazol-1-ylmethyl)-3-(4-pyridyl)propyl]thio]phenyl]piperazino]ethanone Formula: C24H29N5OS MolecularWeight: 435.58496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)SC(CCC3=CC=NC=C3)CN4C=CN=C4

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC=C(C=C2)SC(CCC3=CC=NC=C3)CN4C=CN=C4

InChI

InChI=1S/C24H29N5OS/c1-20(30)28-14-16-29(17-15-28)22-3-6-23(7-4-22)31-24(18-27-13-12-26-19-27)5-2-21-8-10-25-11-9-21/h3-4,6-13,19,24H,2,5,14-18H2,1H3