N-[4-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanylbutyl]-2-fluoranyl-benzamide

Systemtic Name: N-[4-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanylbutyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanylbutyl]-2-fluoro-benzamide CAS Name: N-[4-[[1-ethyl-4,5-bis(4-methoxyphenyl)-2-imidazolyl]thio]butyl]-2-fluorobenzamide IUPAC Name: N-[4-[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanylbutyl]-2-fluorobenzamide Traditional Name: N-[4-[[1-ethyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]thio]butyl]-2-fluoro-benzamide Formula: C30H32FN3O3S MolecularWeight: 533.656783

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(N=C1SCCCCNC(=O)C2=CC=CC=C2F)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

Isomeric SMILES

CCN1C(=C(N=C1SCCCCNC(=O)C2=CC=CC=C2F)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

InChI

InChI=1S/C30H32FN3O3S/c1-4-34-28(22-13-17-24(37-3)18-14-22)27(21-11-15-23(36-2)16-12-21)33-30(34)38-20-8-7-19-32-29(35)25-9-5-6-10-26(25)31/h5-6,9-18H,4,7-8,19-20H2,1-3H3,(H,32,35)