1-(6-chloranylpyridazin-3-yl)-N-[1-(4-methylsulfanylphenyl)ethyl]piperidine-3-carboxamide

Systemtic Name: 1-(6-chloranylpyridazin-3-yl)-N-[1-(4-methylsulfanylphenyl)ethyl]piperidine-3-carboxamide Openeye Name: 1-(6-chloropyridazin-3-yl)-N-[1-(4-methylsulfanylphenyl)ethyl]piperidine-3-carboxamide CAS Name: 1-(6-chloro-3-pyridazinyl)-N-[1-[4-(methylthio)phenyl]ethyl]-3-piperidinecarboxamide IUPAC Name: 1-(6-chloropyridazin-3-yl)-N-[1-(4-methylsulfanylphenyl)ethyl]piperidine-3-carboxamide Traditional Name: 1-(6-chloropyridazin-3-yl)-N-[1-[4-(methylthio)phenyl]ethyl]nipecotamide Formula: C19H23ClN4OS MolecularWeight: 390.93012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23ClN4OS/c1-13(14-5-7-16(26-2)8-6-14)21-19(25)15-4-3-11-24(12-15)18-10-9-17(20)22-23-18/h5-10,13,15H,3-4,11-12H2,1-2H3,(H,21,25)