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

Systemtic Name: N-(4-butylphenyl)-4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazine-1-carboxamide Openeye Name: N-(4-butylphenyl)-4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazine-1-carboxamide CAS Name: N-(4-butylphenyl)-4-[6-(2,5-dimethoxyphenyl)-3-pyridazinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-butylphenyl)-4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazine-1-carboxamide Traditional Name: N-(4-butylphenyl)-4-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]piperazine-1-carboxamide Formula: C27H33N5O3 MolecularWeight: 475.58262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C27H33N5O3/c1-4-5-6-20-7-9-21(10-8-20)28-27(33)32-17-15-31(16-18-32)26-14-12-24(29-30-26)23-19-22(34-2)11-13-25(23)35-3/h7-14,19H,4-6,15-18H2,1-3H3,(H,28,33)