(E)-3-(4-bromophenyl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-bromophenyl)-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-3-(4-bromophenyl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-bromophenyl)-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-bromophenyl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-bromophenyl)-1-[4-(2-thenoyl)piperazino]prop-2-en-1-one Formula: C18H17BrN2O2S MolecularWeight: 405.30878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CC=C(C=C2)Br)C(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CC=C(C=C2)Br)C(=O)C3=CC=CS3

InChI

InChI=1S/C18H17BrN2O2S/c19-15-6-3-14(4-7-15)5-8-17(22)20-9-11-21(12-10-20)18(23)16-2-1-13-24-16/h1-8,13H,9-12H2/b8-5+