4-chloranyl-5-(4-ethylpiperazin-4-ium-1-yl)-2-(1-methylbenzimidazol-2-yl)pyridazin-3-one

Systemtic Name: 4-chloranyl-5-(4-ethylpiperazin-4-ium-1-yl)-2-(1-methylbenzimidazol-2-yl)pyridazin-3-one Openeye Name: 4-chloro-5-(4-ethylpiperazin-4-ium-1-yl)-2-(1-methylbenzimidazol-2-yl)pyridazin-3-one CAS Name: 4-chloro-5-(4-ethyl-1-piperazin-4-iumyl)-2-(1-methyl-2-benzimidazolyl)-3-pyridazinone IUPAC Name: 4-chloro-5-(4-ethylpiperazin-4-ium-1-yl)-2-(1-methylbenzimidazol-2-yl)pyridazin-3-one Traditional Name: 4-chloro-5-(4-ethylpiperazin-4-ium-1-yl)-2-(1-methylbenzimidazol-2-yl)pyridazin-3-one Formula: C18H22ClN6O+ MolecularWeight: 373.85988

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C(=O)N(N=C2)C3=NC4=CC=CC=C4N3C)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C(=O)N(N=C2)C3=NC4=CC=CC=C4N3C)Cl

InChI

InChI=1S/C18H21ClN6O/c1-3-23-8-10-24(11-9-23)15-12-20-25(17(26)16(15)19)18-21-13-6-4-5-7-14(13)22(18)2/h4-7,12H,3,8-11H2,1-2H3/p+1