N-[1-(3-bromophenyl)ethyl]-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-[1-(3-bromophenyl)ethyl]-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-[1-(3-bromophenyl)ethyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-[1-(3-bromophenyl)ethyl]-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-[1-(3-bromophenyl)ethyl]-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: N-[1-(3-bromophenyl)ethyl]-6-keto-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C21H20BrN3O3 MolecularWeight: 442.3058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Br)NC(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3

Isomeric SMILES

CC(C1=CC(=CC=C1)Br)NC(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3

InChI

InChI=1S/C21H20BrN3O3/c1-15(16-6-5-7-17(22)14-16)23-21(27)19-10-11-20(26)25(24-19)12-13-28-18-8-3-2-4-9-18/h2-11,14-15H,12-13H2,1H3,(H,23,27)