3-[4-(5-bromanyl-2-ethoxy-phenyl)sulfonylpiperazin-1-yl]-6-pyrazol-1-yl-pyridazine

Systemtic Name: 3-[4-(5-bromanyl-2-ethoxy-phenyl)sulfonylpiperazin-1-yl]-6-pyrazol-1-yl-pyridazine Openeye Name: 3-[4-(5-bromo-2-ethoxy-phenyl)sulfonylpiperazin-1-yl]-6-pyrazol-1-yl-pyridazine CAS Name: 3-[4-(5-bromo-2-ethoxyphenyl)sulfonyl-1-piperazinyl]-6-(1-pyrazolyl)pyridazine IUPAC Name: 3-[4-(5-bromo-2-ethoxyphenyl)sulfonylpiperazin-1-yl]-6-pyrazol-1-ylpyridazine Traditional Name: 3-[4-(5-bromo-2-ethoxy-phenyl)sulfonylpiperazino]-6-pyrazol-1-yl-pyridazine Formula: C19H21BrN6O3S MolecularWeight: 493.37744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)N4C=CC=N4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C19H21BrN6O3S/c1-2-29-16-5-4-15(20)14-17(16)30(27,28)25-12-10-24(11-13-25)18-6-7-19(23-22-18)26-9-3-8-21-26/h3-9,14H,2,10-13H2,1H3