[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-[4-(methylsulfonylmethyl)phenyl]methanone

Systemtic Name: [4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-[4-(methylsulfonylmethyl)phenyl]methanone Openeye Name: [4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-[4-(methylsulfonylmethyl)phenyl]methanone CAS Name: [4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-[4-(methylsulfonylmethyl)phenyl]methanone IUPAC Name: [4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-[4-(methylsulfonylmethyl)phenyl]methanone Traditional Name: [4-(5-bromopyrimidin-2-yl)piperazino]-[4-(mesylmethyl)phenyl]methanone Formula: C17H19BrN4O3S MolecularWeight: 439.32676

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=N3)Br

Isomeric SMILES

CS(=O)(=O)CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=C(C=N3)Br

InChI

InChI=1S/C17H19BrN4O3S/c1-26(24,25)12-13-2-4-14(5-3-13)16(23)21-6-8-22(9-7-21)17-19-10-15(18)11-20-17/h2-5,10-11H,6-9,12H2,1H3