4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(3-chlorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(3-chlorophenyl)piperazine-1-carboxamide Openeye Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(3-chlorophenyl)piperazine-1-carboxamide CAS Name: 4-[6-(1,3-benzodioxol-5-yl)-3-pyridazinyl]-N-(3-chlorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(3-chlorophenyl)piperazine-1-carboxamide Traditional Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(3-chlorophenyl)piperazine-1-carboxamide Formula: C22H20ClN5O3 MolecularWeight: 437.8789

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C3=CC4=C(C=C3)OCO4)C(=O)NC5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC4=C(C=C3)OCO4)C(=O)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C22H20ClN5O3/c23-16-2-1-3-17(13-16)24-22(29)28-10-8-27(9-11-28)21-7-5-18(25-26-21)15-4-6-19-20(12-15)31-14-30-19/h1-7,12-13H,8-11,14H2,(H,24,29)