3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-6-(3,5-dimethylpyrazol-1-yl)pyridazine

Systemtic Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-6-(3,5-dimethylpyrazol-1-yl)pyridazine Openeye Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-6-(3,5-dimethylpyrazol-1-yl)pyridazine CAS Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-1-piperazinyl]-6-(3,5-dimethyl-1-pyrazolyl)pyridazine IUPAC Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazin-1-yl]-6-(3,5-dimethylpyrazol-1-yl)pyridazine Traditional Name: 3-[4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperazino]-6-(3,5-dimethylpyrazol-1-yl)pyridazine Formula: C21H24N6O4S MolecularWeight: 456.51806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)OCCO5)C

InChI

InChI=1S/C21H24N6O4S/c1-15-13-16(2)27(24-15)21-6-5-20(22-23-21)25-7-9-26(10-8-25)32(28,29)17-3-4-18-19(14-17)31-12-11-30-18/h3-6,13-14H,7-12H2,1-2H3