N-[2-(4-bromophenyl)propan-2-yl]-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide

Systemtic Name: N-[2-(4-bromophenyl)propan-2-yl]-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide Openeye Name: 1-benzyl-N-[1-(4-bromophenyl)-1-methyl-ethyl]-6-oxo-pyridazine-3-carboxamide CAS Name: N-[2-(4-bromophenyl)propan-2-yl]-6-oxo-1-(phenylmethyl)-3-pyridazinecarboxamide IUPAC Name: 1-benzyl-N-[2-(4-bromophenyl)propan-2-yl]-6-oxopyridazine-3-carboxamide Traditional Name: 1-benzyl-N-[1-(4-bromophenyl)-1-methyl-ethyl]-6-keto-pyridazine-3-carboxamide Formula: C21H20BrN3O2 MolecularWeight: 426.3064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)Br)NC(=O)C2=NN(C(=O)C=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)Br)NC(=O)C2=NN(C(=O)C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H20BrN3O2/c1-21(2,16-8-10-17(22)11-9-16)23-20(27)18-12-13-19(26)25(24-18)14-15-6-4-3-5-7-15/h3-13H,14H2,1-2H3,(H,23,27)