2-[1-(2,1,3-benzoxadiazol-4-ylsulfonyl)piperidin-4-yl]-6-cyclopropyl-pyridazin-3-one

Systemtic Name: 2-[1-(2,1,3-benzoxadiazol-4-ylsulfonyl)piperidin-4-yl]-6-cyclopropyl-pyridazin-3-one Openeye Name: 2-[1-(2,1,3-benzoxadiazol-4-ylsulfonyl)-4-piperidyl]-6-cyclopropyl-pyridazin-3-one CAS Name: 2-[1-(2,1,3-benzoxadiazol-4-ylsulfonyl)-4-piperidinyl]-6-cyclopropyl-3-pyridazinone IUPAC Name: 2-[1-(2,1,3-benzoxadiazol-4-ylsulfonyl)piperidin-4-yl]-6-cyclopropylpyridazin-3-one Traditional Name: 2-(1-benzofurazan-4-ylsulfonyl-4-piperidyl)-6-cyclopropyl-pyridazin-3-one Formula: C18H19N5O4S MolecularWeight: 401.43956

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN(C(=O)C=C2)C3CCN(CC3)S(=O)(=O)C4=CC=CC5=NON=C54

Isomeric SMILES

C1CC1C2=NN(C(=O)C=C2)C3CCN(CC3)S(=O)(=O)C4=CC=CC5=NON=C54

InChI

InChI=1S/C18H19N5O4S/c24-17-7-6-14(12-4-5-12)19-23(17)13-8-10-22(11-9-13)28(25,26)16-3-1-2-15-18(16)21-27-20-15/h1-3,6-7,12-13H,4-5,8-11H2