3-(3,4-dimethyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-1H-pyridazin-6-one

Systemtic Name: 3-(3,4-dimethyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-1H-pyridazin-6-one Openeye Name: 3-(3,4-dimethyl-5-pyrrolidin-1-ylsulfonyl-phenyl)-1H-pyridazin-6-one CAS Name: 3-[3,4-dimethyl-5-(1-pyrrolidinylsulfonyl)phenyl]-1H-pyridazin-6-one IUPAC Name: 3-(3,4-dimethyl-5-pyrrolidin-1-ylsulfonylphenyl)-1H-pyridazin-6-one Traditional Name: 3-(3,4-dimethyl-5-pyrrolidinosulfonyl-phenyl)-1H-pyridazin-6-one Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C2=NNC(=O)C=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C2=NNC(=O)C=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C16H19N3O3S/c1-11-9-13(14-5-6-16(20)18-17-14)10-15(12(11)2)23(21,22)19-7-3-4-8-19/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,18,20)