5-chloranyl-4-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-1H-pyridazin-6-one

Systemtic Name: 5-chloranyl-4-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-1H-pyridazin-6-one Openeye Name: 5-chloro-4-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-1H-pyridazin-6-one CAS Name: 5-chloro-4-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-1H-pyridazin-6-one IUPAC Name: 5-chloro-4-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-1H-pyridazin-6-one Traditional Name: 5-chloro-4-[4-(4-fluorophenyl)sulfonyl-1,4-diazepan-1-yl]-1H-pyridazin-6-one Formula: C15H16ClFN4O3S MolecularWeight: 386.828943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16ClFN4O3S/c16-14-13(10-18-19-15(14)22)20-6-1-7-21(9-8-20)25(23,24)12-4-2-11(17)3-5-12/h2-5,10H,1,6-9H2,(H,19,22)