4,5-bis(chloranyl)-2-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]pyridazin-3-one

Systemtic Name: 4,5-bis(chloranyl)-2-[(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl]pyridazin-3-one Openeye Name: 4,5-dichloro-2-[[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl]pyridazin-3-one CAS Name: 4,5-dichloro-2-[[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl]-3-pyridazinone IUPAC Name: 4,5-dichloro-2-[(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl]pyridazin-3-one Traditional Name: 4,5-dichloro-2-[(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl]pyridazin-3-one Formula: C19H21Cl2N5O3S MolecularWeight: 470.37274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN4C(=O)C(=C(C=N4)Cl)Cl

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CN4C(=O)C(=C(C=N4)Cl)Cl

InChI

InChI=1S/C19H21Cl2N5O3S/c1-2-25-16-7-6-13(30(28,29)24-8-4-3-5-9-24)10-15(16)23-17(25)12-26-19(27)18(21)14(20)11-22-26/h6-7,10-11H,2-5,8-9,12H2,1H3