N-[1-(4-bromophenyl)propyl]-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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