2-(2-azanyl-4-bromanyl-phenyl)sulfanyl-1-(4-ethanoylpiperazin-1-yl)ethanone

Systemtic Name: 2-(2-azanyl-4-bromanyl-phenyl)sulfanyl-1-(4-ethanoylpiperazin-1-yl)ethanone Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-(2-amino-4-bromo-phenyl)sulfanyl-ethanone CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[(2-amino-4-bromophenyl)thio]ethanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-(2-amino-4-bromophenyl)sulfanylethanone Traditional Name: 1-(4-acetylpiperazino)-2-[(2-amino-4-bromo-phenyl)thio]ethanone Formula: C14H18BrN3O2S MolecularWeight: 372.28062

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CSC2=C(C=C(C=C2)Br)N

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CSC2=C(C=C(C=C2)Br)N

InChI

InChI=1S/C14H18BrN3O2S/c1-10(19)17-4-6-18(7-5-17)14(20)9-21-13-3-2-11(15)8-12(13)16/h2-3,8H,4-7,9,16H2,1H3