2-(1H-benzimidazol-2-yl)-4-chloranyl-5-(3-oxidanylpropylamino)pyridazin-3-one

Systemtic Name: 2-(1H-benzimidazol-2-yl)-4-chloranyl-5-(3-oxidanylpropylamino)pyridazin-3-one Openeye Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-(3-hydroxypropylamino)pyridazin-3-one CAS Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-(3-hydroxypropylamino)-3-pyridazinone IUPAC Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-(3-hydroxypropylamino)pyridazin-3-one Traditional Name: 2-(1H-benzimidazol-2-yl)-4-chloro-5-(3-hydroxypropylamino)pyridazin-3-one Formula: C14H14ClN5O2 MolecularWeight: 319.74626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)N3C(=O)C(=C(C=N3)NCCCO)Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)N3C(=O)C(=C(C=N3)NCCCO)Cl

InChI

InChI=1S/C14H14ClN5O2/c15-12-11(16-6-3-7-21)8-17-20(13(12)22)14-18-9-4-1-2-5-10(9)19-14/h1-2,4-5,8,16,21H,3,6-7H2,(H,18,19)