[1-[6-(5-bromanylthiophen-2-yl)pyridazin-3-yl]piperidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [1-[6-(5-bromanylthiophen-2-yl)pyridazin-3-yl]piperidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [1-[6-(5-bromo-2-thienyl)pyridazin-3-yl]-4-piperidyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [1-[6-(5-bromo-2-thiophenyl)-3-pyridazinyl]-4-piperidinyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [1-[6-(5-bromothiophen-2-yl)pyridazin-3-yl]piperidin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [1-[6-(5-bromo-2-thienyl)pyridazin-3-yl]-4-piperidyl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C22H24BrN7OS MolecularWeight: 514.44126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)C3=NC=CC=N3)C4=NN=C(C=C4)C5=CC=C(S5)Br

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)C3=NC=CC=N3)C4=NN=C(C=C4)C5=CC=C(S5)Br

InChI

InChI=1S/C22H24BrN7OS/c23-19-4-3-18(32-19)17-2-5-20(27-26-17)28-10-6-16(7-11-28)21(31)29-12-14-30(15-13-29)22-24-8-1-9-25-22/h1-5,8-9,16H,6-7,10-15H2