3-[4-[(2R)-4-(4-methylsulfonylphenoxy)butan-2-yl]piperidin-1-yl]pyridazine

Systemtic Name: 3-[4-[(2R)-4-(4-methylsulfonylphenoxy)butan-2-yl]piperidin-1-yl]pyridazine Openeye Name: 3-[4-[(1R)-1-methyl-3-(4-methylsulfonylphenoxy)propyl]-1-piperidyl]pyridazine CAS Name: 3-[4-[(2R)-4-(4-methylsulfonylphenoxy)butan-2-yl]-1-piperidinyl]pyridazine IUPAC Name: 3-[4-[(2R)-4-(4-methylsulfonylphenoxy)butan-2-yl]piperidin-1-yl]pyridazine Traditional Name: 3-[4-[(1R)-3-(4-mesylphenoxy)-1-methyl-propyl]piperidino]pyridazine Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC1=CC=C(C=C1)S(=O)(=O)C)C2CCN(CC2)C3=NN=CC=C3

Isomeric SMILES

C[C@H](CCOC1=CC=C(C=C1)S(=O)(=O)C)C2CCN(CC2)C3=NN=CC=C3

InChI

InChI=1S/C20H27N3O3S/c1-16(11-15-26-18-5-7-19(8-6-18)27(2,24)25)17-9-13-23(14-10-17)20-4-3-12-21-22-20/h3-8,12,16-17H,9-11,13-15H2,1-2H3/t16-/m1/s1