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

Systemtic Name: S-[1-[2,4-bis(bromanyl)phenyl]-2-imidazol-1-yl-ethyl] 4-chloranylbenzenecarbothioate Openeye Name: S-[1-(2,4-dibromophenyl)-2-imidazol-1-yl-ethyl] 4-chlorobenzenecarbothioate CAS Name: 4-chlorobenzenecarbothioic acid S-[1-(2,4-dibromophenyl)-2-(1-imidazolyl)ethyl] ester IUPAC Name: S-[1-(2,4-dibromophenyl)-2-imidazol-1-ylethyl] 4-chlorobenzenecarbothioate Traditional Name: 4-chlorothiobenzoic acid S-[1-(2,4-dibromophenyl)-2-imidazol-1-yl-ethyl] ester Formula: C18H13Br2ClN2OS MolecularWeight: 500.63462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)SC(CN2C=CN=C2)C3=C(C=C(C=C3)Br)Br)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)SC(CN2C=CN=C2)C3=C(C=C(C=C3)Br)Br)Cl

InChI

InChI=1S/C18H13Br2ClN2OS/c19-13-3-6-15(16(20)9-13)17(10-23-8-7-22-11-23)25-18(24)12-1-4-14(21)5-2-12/h1-9,11,17H,10H2