1,3-bis[[4-(4-fluorophenyl)-5-pyridin-4-yl-1H-imidazol-2-yl]sulfanyl]propan-2-one

Systemtic Name: 1,3-bis[[4-(4-fluorophenyl)-5-pyridin-4-yl-1H-imidazol-2-yl]sulfanyl]propan-2-one Openeye Name: 1,3-bis[[4-(4-fluorophenyl)-5-(4-pyridyl)-1H-imidazol-2-yl]sulfanyl]propan-2-one CAS Name: 1,3-bis[[4-(4-fluorophenyl)-5-pyridin-4-yl-1H-imidazol-2-yl]thio]-2-propanone IUPAC Name: 1,3-bis[[4-(4-fluorophenyl)-5-pyridin-4-yl-1H-imidazol-2-yl]sulfanyl]propan-2-one Traditional Name: 1,3-bis[[4-(4-fluorophenyl)-5-(4-pyridyl)-1H-imidazol-2-yl]thio]acetone Formula: C31H22F2N6OS2 MolecularWeight: 596.672786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(NC(=N2)SCC(=O)CSC3=NC(=C(N3)C4=CC=NC=C4)C5=CC=C(C=C5)F)C6=CC=NC=C6)F

Isomeric SMILES

C1=CC(=CC=C1C2=C(NC(=N2)SCC(=O)CSC3=NC(=C(N3)C4=CC=NC=C4)C5=CC=C(C=C5)F)C6=CC=NC=C6)F

InChI

InChI=1S/C31H22F2N6OS2/c32-23-5-1-19(2-6-23)26-28(21-9-13-34-14-10-21)38-30(36-26)41-17-25(40)18-42-31-37-27(20-3-7-24(33)8-4-20)29(39-31)22-11-15-35-16-12-22/h1-16H,17-18H2,(H,36,38)(H,37,39)