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

Systemtic Name: 3-[4-(2-methyl-5-propan-2-yl-phenyl)sulfonylpiperazin-1-yl]-6-pyrazol-1-yl-pyridazine Openeye Name: 3-[4-(5-isopropyl-2-methyl-phenyl)sulfonylpiperazin-1-yl]-6-pyrazol-1-yl-pyridazine CAS Name: 3-[4-(2-methyl-5-propan-2-ylphenyl)sulfonyl-1-piperazinyl]-6-(1-pyrazolyl)pyridazine IUPAC Name: 3-[4-(2-methyl-5-propan-2-ylphenyl)sulfonylpiperazin-1-yl]-6-pyrazol-1-ylpyridazine Traditional Name: 3-[4-(5-isopropyl-2-methyl-phenyl)sulfonylpiperazino]-6-pyrazol-1-yl-pyridazine Formula: C21H26N6O2S MolecularWeight: 426.53514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)C)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)N4C=CC=N4

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)C)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C21H26N6O2S/c1-16(2)18-6-5-17(3)19(15-18)30(28,29)26-13-11-25(12-14-26)20-7-8-21(24-23-20)27-10-4-9-22-27/h4-10,15-16H,11-14H2,1-3H3