1-(4-bromophenyl)-4-[4-(thiophen-2-ylmethyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(4-bromophenyl)-4-[4-(thiophen-2-ylmethyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(4-bromophenyl)-4-[4-(2-thienylmethyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(4-bromophenyl)-4-[4-(thiophen-2-ylmethyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(4-bromophenyl)-4-[4-(thiophen-2-ylmethyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(4-bromophenyl)-4-[4-(2-thenyl)piperazino]butane-1,4-dione Formula: C19H21BrN2O2S MolecularWeight: 421.35124

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CS2)C(=O)CCC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CS2)C(=O)CCC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H21BrN2O2S/c20-16-5-3-15(4-6-16)18(23)7-8-19(24)22-11-9-21(10-12-22)14-17-2-1-13-25-17/h1-6,13H,7-12,14H2