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

Systemtic Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(3-methoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(3-methoxyphenyl)piperazine-1-carboxamide CAS Name: 4-[6-(1,3-benzodioxol-5-yl)-3-pyridazinyl]-N-(3-methoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(3-methoxyphenyl)piperazine-1-carboxamide Traditional Name: 4-[6-(1,3-benzodioxol-5-yl)pyridazin-3-yl]-N-(3-methoxyphenyl)piperazine-1-carboxamide Formula: C23H23N5O4 MolecularWeight: 433.45982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H23N5O4/c1-30-18-4-2-3-17(14-18)24-23(29)28-11-9-27(10-12-28)22-8-6-19(25-26-22)16-5-7-20-21(13-16)32-15-31-20/h2-8,13-14H,9-12,15H2,1H3,(H,24,29)