3-[[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,4-diazepan-1-yl]carbonyl]-1H-pyridazin-6-one

Systemtic Name: 3-[[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,4-diazepan-1-yl]carbonyl]-1H-pyridazin-6-one Openeye Name: 3-[4-(3,5-dimethylisoxazol-4-yl)sulfonyl-1,4-diazepane-1-carbonyl]-1H-pyridazin-6-one CAS Name: 3-[[4-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1,4-diazepan-1-yl]-oxomethyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1,4-diazepane-1-carbonyl]-1H-pyridazin-6-one Traditional Name: 3-[4-(3,5-dimethylisoxazol-4-yl)sulfonyl-1,4-diazepane-1-carbonyl]-1H-pyridazin-6-one Formula: C15H19N5O5S MolecularWeight: 381.40686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCN(CC2)C(=O)C3=NNC(=O)C=C3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCCN(CC2)C(=O)C3=NNC(=O)C=C3

InChI

InChI=1S/C15H19N5O5S/c1-10-14(11(2)25-18-10)26(23,24)20-7-3-6-19(8-9-20)15(22)12-4-5-13(21)17-16-12/h4-5H,3,6-9H2,1-2H3,(H,17,21)