[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetate CAS Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetate Traditional Name: 2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C18H15BrN2O3S MolecularWeight: 419.2923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)OCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC(=O)OCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H15BrN2O3S/c1-11-2-7-14-15(8-11)21-18(20-14)25-10-17(23)24-9-16(22)12-3-5-13(19)6-4-12/h2-8H,9-10H2,1H3,(H,20,21)