3-[3-(2-ethylpiperidin-1-yl)sulfonyl-4,5-dimethyl-phenyl]-1H-pyridazin-6-one

Systemtic Name: 3-[3-(2-ethylpiperidin-1-yl)sulfonyl-4,5-dimethyl-phenyl]-1H-pyridazin-6-one Openeye Name: 3-[3-[(2-ethyl-1-piperidyl)sulfonyl]-4,5-dimethyl-phenyl]-1H-pyridazin-6-one CAS Name: 3-[3-[(2-ethyl-1-piperidinyl)sulfonyl]-4,5-dimethylphenyl]-1H-pyridazin-6-one IUPAC Name: 3-[3-(2-ethylpiperidin-1-yl)sulfonyl-4,5-dimethylphenyl]-1H-pyridazin-6-one Traditional Name: 3-[3-(2-ethylpiperidino)sulfonyl-4,5-dimethyl-phenyl]-1H-pyridazin-6-one Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC(=CC(=C2C)C)C3=NNC(=O)C=C3

Isomeric SMILES

CCC1CCCCN1S(=O)(=O)C2=CC(=CC(=C2C)C)C3=NNC(=O)C=C3

InChI

InChI=1S/C19H25N3O3S/c1-4-16-7-5-6-10-22(16)26(24,25)18-12-15(11-13(2)14(18)3)17-8-9-19(23)21-20-17/h8-9,11-12,16H,4-7,10H2,1-3H3,(H,21,23)