S-[1-[2,4-bis(bromanyl)phenyl]-2-imidazol-1-yl-ethyl] octanethioate

Systemtic Name: S-[1-[2,4-bis(bromanyl)phenyl]-2-imidazol-1-yl-ethyl] octanethioate Openeye Name: S-[1-(2,4-dibromophenyl)-2-imidazol-1-yl-ethyl] octanethioate CAS Name: octanethioic acid S-[1-(2,4-dibromophenyl)-2-(1-imidazolyl)ethyl] ester IUPAC Name: S-[1-(2,4-dibromophenyl)-2-imidazol-1-ylethyl] octanethioate Traditional Name: octanethioic acid S-[1-(2,4-dibromophenyl)-2-imidazol-1-yl-ethyl] ester Formula: C19H24Br2N2OS MolecularWeight: 488.27966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)SC(CN1C=CN=C1)C2=C(C=C(C=C2)Br)Br

Isomeric SMILES

CCCCCCCC(=O)SC(CN1C=CN=C1)C2=C(C=C(C=C2)Br)Br

InChI

InChI=1S/C19H24Br2N2OS/c1-2-3-4-5-6-7-19(24)25-18(13-23-11-10-22-14-23)16-9-8-15(20)12-17(16)21/h8-12,14,18H,2-7,13H2,1H3