S-[1-(4-bromophenyl)carbonylbenzimidazol-2-yl] 4-bromanylbenzenecarbothioate

Systemtic Name: S-[1-(4-bromophenyl)carbonylbenzimidazol-2-yl] 4-bromanylbenzenecarbothioate Openeye Name: S-[1-(4-bromobenzoyl)benzimidazol-2-yl] 4-bromobenzenecarbothioate CAS Name: 4-bromobenzenecarbothioic acid S-[1-[(4-bromophenyl)-oxomethyl]-2-benzimidazolyl] ester IUPAC Name: S-[1-(4-bromobenzoyl)benzimidazol-2-yl] 4-bromobenzenecarbothioate Traditional Name: 4-bromothiobenzoic acid S-[1-(4-bromobenzoyl)benzimidazol-2-yl] ester Formula: C21H12Br2N2O2S MolecularWeight: 516.20518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2C(=O)C3=CC=C(C=C3)Br)SC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2C(=O)C3=CC=C(C=C3)Br)SC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H12Br2N2O2S/c22-15-9-5-13(6-10-15)19(26)25-18-4-2-1-3-17(18)24-21(25)28-20(27)14-7-11-16(23)12-8-14/h1-12H