6-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]carbonyl-2-propyl-pyridazin-3-one

Systemtic Name: 6-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]carbonyl-2-propyl-pyridazin-3-one Openeye Name: 6-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]-2-propyl-pyridazin-3-one CAS Name: 6-[[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-propyl-3-pyridazinone IUPAC Name: 6-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]-2-propylpyridazin-3-one Traditional Name: 6-[4-(4-tert-butylphenyl)sulfonylpiperazine-1-carbonyl]-2-propyl-pyridazin-3-one Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H30N4O4S/c1-5-12-26-20(27)11-10-19(23-26)21(28)24-13-15-25(16-14-24)31(29,30)18-8-6-17(7-9-18)22(2,3)4/h6-11H,5,12-16H2,1-4H3