N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-methyl-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-methyl-6-oxo-pyridazine-3-carboxamide CAS Name: N-[5-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-1-methyl-6-oxo-3-pyridazinecarboxamide IUPAC Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-1-methyl-6-oxopyridazine-3-carboxamide Traditional Name: N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-6-keto-1-methyl-pyridazine-3-carboxamide Formula: C18H23ClN5O2+ MolecularWeight: 376.86052

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=NN(C(=O)C=C3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=NN(C(=O)C=C3)C

InChI

InChI=1S/C18H22ClN5O2/c1-3-23-8-10-24(11-9-23)16-6-4-13(19)12-15(16)20-18(26)14-5-7-17(25)22(2)21-14/h4-7,12H,3,8-11H2,1-2H3,(H,20,26)/p+1