4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-thiophen-2-yl-piperazine-1-carboxamide

Systemtic Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-thiophen-2-yl-piperazine-1-carboxamide Openeye Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(2-thienyl)piperazine-1-carboxamide CAS Name: 4-[6-(1,3-benzodioxol-5-yl)-3-pyridazinyl]-N-thiophen-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-thiophen-2-ylpiperazine-1-carboxamide Traditional Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(2-thienyl)piperazine-1-carboxamide Formula: C20H19N5O3S MolecularWeight: 409.46156

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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=CS5

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C3=CC4=C(C=C3)OCO4)C(=O)NC5=CC=CS5

InChI

InChI=1S/C20H19N5O3S/c26-20(21-19-2-1-11-29-19)25-9-7-24(8-10-25)18-6-4-15(22-23-18)14-3-5-16-17(12-14)28-13-27-16/h1-6,11-12H,7-10,13H2,(H,21,26)