N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: 6-keto-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C25H30N5O3+ MolecularWeight: 448.5374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=NN(C(=O)C=C3)CCOC4=CC=CC=C4

InChI

InChI=1S/C25H29N5O3/c1-19-18-20(29-14-12-28(2)13-15-29)8-9-22(19)26-25(32)23-10-11-24(31)30(27-23)16-17-33-21-6-4-3-5-7-21/h3-11,18H,12-17H2,1-2H3,(H,26,32)/p+1