3-[4-(3-azanylpropylsulfonyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[4-(3-azanylpropylsulfonyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[4-(3-aminopropylsulfonyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[4-(3-aminopropylsulfonyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[4-(3-aminopropylsulfonyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 3-[4-(3-aminopropylsulfonyl)phenyl]-4,5-dihydro-1H-pyridazin-6-one Formula: C13H17N3O3S MolecularWeight: 295.35738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NN=C1C2=CC=C(C=C2)S(=O)(=O)CCCN

Isomeric SMILES

C1CC(=O)NN=C1C2=CC=C(C=C2)S(=O)(=O)CCCN

InChI

InChI=1S/C13H17N3O3S/c14-8-1-9-20(18,19)11-4-2-10(3-5-11)12-6-7-13(17)16-15-12/h2-5H,1,6-9,14H2,(H,16,17)