(3S)-N-(4-oxidanylcyclohexyl)-1-(6-phenylpyridazin-3-yl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-(4-oxidanylcyclohexyl)-1-(6-phenylpyridazin-3-yl)piperidine-3-carboxamide Openeye Name: (3S)-N-(4-hydroxycyclohexyl)-1-(6-phenylpyridazin-3-yl)piperidine-3-carboxamide CAS Name: (3S)-N-(4-hydroxycyclohexyl)-1-(6-phenyl-3-pyridazinyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-(4-hydroxycyclohexyl)-1-(6-phenylpyridazin-3-yl)piperidine-3-carboxamide Traditional Name: (3S)-N-(4-hydroxycyclohexyl)-1-(6-phenylpyridazin-3-yl)nipecotamide Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NN=C(C=C2)C3=CC=CC=C3)C(=O)NC4CCC(CC4)O

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NN=C(C=C2)C3=CC=CC=C3)C(=O)NC4CCC(CC4)O

InChI

InChI=1S/C22H28N4O2/c27-19-10-8-18(9-11-19)23-22(28)17-7-4-14-26(15-17)21-13-12-20(24-25-21)16-5-2-1-3-6-16/h1-3,5-6,12-13,17-19,27H,4,7-11,14-15H2,(H,23,28)/t17-,18?,19?/m0/s1