2-phenyl-6-(4-propylsulfonyl-1,4-diazepan-1-yl)pyridazin-3-one

Systemtic Name: 2-phenyl-6-(4-propylsulfonyl-1,4-diazepan-1-yl)pyridazin-3-one Openeye Name: 2-phenyl-6-(4-propylsulfonyl-1,4-diazepan-1-yl)pyridazin-3-one CAS Name: 2-phenyl-6-(4-propylsulfonyl-1,4-diazepan-1-yl)-3-pyridazinone IUPAC Name: 2-phenyl-6-(4-propylsulfonyl-1,4-diazepan-1-yl)pyridazin-3-one Traditional Name: 2-phenyl-6-(4-propylsulfonyl-1,4-diazepan-1-yl)pyridazin-3-one Formula: C18H24N4O3S MolecularWeight: 376.47316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCN(CC1)C2=NN(C(=O)C=C2)C3=CC=CC=C3

Isomeric SMILES

CCCS(=O)(=O)N1CCCN(CC1)C2=NN(C(=O)C=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H24N4O3S/c1-2-15-26(24,25)21-12-6-11-20(13-14-21)17-9-10-18(23)22(19-17)16-7-4-3-5-8-16/h3-5,7-10H,2,6,11-15H2,1H3