N-(4-tert-butylphenyl)-1-(6-chloranylpyridazin-3-yl)piperidine-3-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-1-(6-chloranylpyridazin-3-yl)piperidine-3-carboxamide Openeye Name: N-(4-tert-butylphenyl)-1-(6-chloropyridazin-3-yl)piperidine-3-carboxamide CAS Name: N-(4-tert-butylphenyl)-1-(6-chloro-3-pyridazinyl)-3-piperidinecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-1-(6-chloropyridazin-3-yl)piperidine-3-carboxamide Traditional Name: N-(4-tert-butylphenyl)-1-(6-chloropyridazin-3-yl)nipecotamide Formula: C20H25ClN4O MolecularWeight: 372.8917

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)C3=NN=C(C=C3)Cl

InChI

InChI=1S/C20H25ClN4O/c1-20(2,3)15-6-8-16(9-7-15)22-19(26)14-5-4-12-25(13-14)18-11-10-17(21)23-24-18/h6-11,14H,4-5,12-13H2,1-3H3,(H,22,26)