2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-[[1-(4-bromophenyl)-2-imidazolyl]thio]-1-[4-(4-methoxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[[1-(4-bromophenyl)imidazol-2-yl]thio]-1-[4-(4-methoxyphenyl)piperazino]ethanone Formula: C22H23BrN4O2S MolecularWeight: 487.41262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CSC3=NC=CN3C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)CSC3=NC=CN3C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H23BrN4O2S/c1-29-20-8-6-18(7-9-20)25-12-14-26(15-13-25)21(28)16-30-22-24-10-11-27(22)19-4-2-17(23)3-5-19/h2-11H,12-16H2,1H3