N-(4-bromanyl-2-methyl-phenyl)-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-6-oxidanylidene-1-(2-phenoxyethyl)pyridazine-3-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-6-oxo-1-(2-phenoxyethyl)-3-pyridazinecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-6-oxo-1-(2-phenoxyethyl)pyridazine-3-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-6-keto-1-(2-phenoxyethyl)pyridazine-3-carboxamide Formula: C20H18BrN3O3 MolecularWeight: 428.27922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2=NN(C(=O)C=C2)CCOC3=CC=CC=C3

InChI

InChI=1S/C20H18BrN3O3/c1-14-13-15(21)7-8-17(14)22-20(26)18-9-10-19(25)24(23-18)11-12-27-16-5-3-2-4-6-16/h2-10,13H,11-12H2,1H3,(H,22,26)