1-(6-chloranylpyridazin-3-yl)-N-(5-ethylsulfonyl-2-oxidanyl-phenyl)piperidine-4-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-(5-ethylsulfonyl-2-oxidanyl-phenyl)piperidine-4-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-(5-ethylsulfonyl-2-hydroxy-phenyl)piperidine-4-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-(5-ethylsulfonyl-2-hydroxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-(5-ethylsulfonyl-2-hydroxyphenyl)piperidine-4-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-(5-esyl-2-hydroxy-phenyl)isonipecotamide Formula: C18H21ClN4O4S MolecularWeight: 424.90174

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)C2CCN(CC2)C3=NN=C(C=C3)Cl

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(C=C1)O)NC(=O)C2CCN(CC2)C3=NN=C(C=C3)Cl

InChI

InChI=1S/C18H21ClN4O4S/c1-2-28(26,27)13-3-4-15(24)14(11-13)20-18(25)12-7-9-23(10-8-12)17-6-5-16(19)21-22-17/h3-6,11-12,24H,2,7-10H2,1H3,(H,20,25)