N-[4-[1-ethyl-4,5-bis(4-methylphenyl)imidazol-2-yl]sulfanylbutyl]-3-fluoranyl-benzamide

Systemtic Name: N-[4-[1-ethyl-4,5-bis(4-methylphenyl)imidazol-2-yl]sulfanylbutyl]-3-fluoranyl-benzamide Openeye Name: N-[4-[1-ethyl-4,5-bis(p-tolyl)imidazol-2-yl]sulfanylbutyl]-3-fluoro-benzamide CAS Name: N-[4-[[1-ethyl-4,5-bis(4-methylphenyl)-2-imidazolyl]thio]butyl]-3-fluorobenzamide IUPAC Name: N-[4-[1-ethyl-4,5-bis(4-methylphenyl)imidazol-2-yl]sulfanylbutyl]-3-fluorobenzamide Traditional Name: N-[4-[[1-ethyl-4,5-bis(p-tolyl)imidazol-2-yl]thio]butyl]-3-fluoro-benzamide Formula: C30H32FN3OS MolecularWeight: 501.657983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H32FN3OS/c1-4-34-28(24-16-12-22(3)13-17-24)27(23-14-10-21(2)11-15-23)33-30(34)36-19-6-5-18-32-29(35)25-8-7-9-26(31)20-25/h7-17,20H,4-6,18-19H2,1-3H3,(H,32,35)