1-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-4-(2,5-dimethylthiophen-3-yl)butane-1,4-dione

Systemtic Name: 1-[4-(5-bromanylpyridin-2-yl)piperazin-1-yl]-4-(2,5-dimethylthiophen-3-yl)butane-1,4-dione Openeye Name: 1-[4-(5-bromo-2-pyridyl)piperazin-1-yl]-4-(2,5-dimethyl-3-thienyl)butane-1,4-dione CAS Name: 1-[4-(5-bromo-2-pyridinyl)-1-piperazinyl]-4-(2,5-dimethyl-3-thiophenyl)butane-1,4-dione IUPAC Name: 1-[4-(5-bromopyridin-2-yl)piperazin-1-yl]-4-(2,5-dimethylthiophen-3-yl)butane-1,4-dione Traditional Name: 1-[4-(5-bromo-2-pyridyl)piperazino]-4-(2,5-dimethyl-3-thienyl)butane-1,4-dione Formula: C19H22BrN3O2S MolecularWeight: 436.36588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)N2CCN(CC2)C3=NC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)N2CCN(CC2)C3=NC=C(C=C3)Br

InChI

InChI=1S/C19H22BrN3O2S/c1-13-11-16(14(2)26-13)17(24)4-6-19(25)23-9-7-22(8-10-23)18-5-3-15(20)12-21-18/h3,5,11-12H,4,6-10H2,1-2H3