6-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]-2-phenyl-4,5-dihydropyridazin-3-one

Systemtic Name: 6-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]carbonyl]-2-phenyl-4,5-dihydropyridazin-3-one Openeye Name: 6-[4-(4-fluorophenyl)sulfonyl-1,4-diazepane-1-carbonyl]-2-phenyl-4,5-dihydropyridazin-3-one CAS Name: 6-[[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-oxomethyl]-2-phenyl-4,5-dihydropyridazin-3-one IUPAC Name: 6-[4-(4-fluorophenyl)sulfonyl-1,4-diazepane-1-carbonyl]-2-phenyl-4,5-dihydropyridazin-3-one Traditional Name: 6-[4-(4-fluorophenyl)sulfonyl-1,4-diazepane-1-carbonyl]-2-phenyl-4,5-dihydropyridazin-3-one Formula: C22H23FN4O4S MolecularWeight: 458.505823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)C3=NN(C(=O)CC3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)C2=CC=C(C=C2)F)C(=O)C3=NN(C(=O)CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H23FN4O4S/c23-17-7-9-19(10-8-17)32(30,31)26-14-4-13-25(15-16-26)22(29)20-11-12-21(28)27(24-20)18-5-2-1-3-6-18/h1-3,5-10H,4,11-16H2