S-[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] 4-bromanylbenzenecarbothioate

Systemtic Name: S-[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] 4-bromanylbenzenecarbothioate Openeye Name: S-[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] 4-bromobenzenecarbothioate CAS Name: 4-bromobenzenecarbothioic acid S-[1-(2,4-dichlorophenyl)-2-(1-imidazolyl)ethyl] ester IUPAC Name: S-[1-(2,4-dichlorophenyl)-2-imidazol-1-ylethyl] 4-bromobenzenecarbothioate Traditional Name: 4-bromothiobenzoic acid S-[1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethyl] ester Formula: C18H13BrCl2N2OS MolecularWeight: 456.18362

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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)Cl)Cl)Br

Isomeric SMILES

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

InChI

InChI=1S/C18H13BrCl2N2OS/c19-13-3-1-12(2-4-13)18(24)25-17(10-23-8-7-22-11-23)15-6-5-14(20)9-16(15)21/h1-9,11,17H,10H2