3-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]-6-pyridin-4-yl-pyridazine

Systemtic Name: 3-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]-6-pyridin-4-yl-pyridazine Openeye Name: 3-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazin-1-yl]-6-(4-pyridyl)pyridazine CAS Name: 3-[4-(4-methoxy-3-methylphenyl)sulfonyl-1-piperazinyl]-6-pyridin-4-ylpyridazine IUPAC Name: 3-[4-(4-methoxy-3-methylphenyl)sulfonylpiperazin-1-yl]-6-pyridin-4-ylpyridazine Traditional Name: 3-[4-(4-methoxy-3-methyl-phenyl)sulfonylpiperazino]-6-(4-pyridyl)pyridazine Formula: C21H23N5O3S MolecularWeight: 425.50402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=NC=C4)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=NC=C4)OC

InChI

InChI=1S/C21H23N5O3S/c1-16-15-18(3-5-20(16)29-2)30(27,28)26-13-11-25(12-14-26)21-6-4-19(23-24-21)17-7-9-22-10-8-17/h3-10,15H,11-14H2,1-2H3