4-[6-(4-ethoxyphenyl)pyridazin-3-yl]-N-(4-phenoxyphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[6-(4-ethoxyphenyl)pyridazin-3-yl]-N-(4-phenoxyphenyl)piperazine-1-carboxamide Openeye Name: 4-[6-(4-ethoxyphenyl)pyridazin-3-yl]-N-(4-phenoxyphenyl)piperazine-1-carboxamide CAS Name: 4-[6-(4-ethoxyphenyl)-3-pyridazinyl]-N-(4-phenoxyphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[6-(4-ethoxyphenyl)pyridazin-3-yl]-N-(4-phenoxyphenyl)piperazine-1-carboxamide Traditional Name: N-(4-phenoxyphenyl)-4-(6-p-phenetylpyridazin-3-yl)piperazine-1-carboxamide Formula: C29H29N5O3 MolecularWeight: 495.57226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C29H29N5O3/c1-2-36-24-12-8-22(9-13-24)27-16-17-28(32-31-27)33-18-20-34(21-19-33)29(35)30-23-10-14-26(15-11-23)37-25-6-4-3-5-7-25/h3-17H,2,18-21H2,1H3,(H,30,35)