N-[(2-chlorophenyl)methyl]-1-[6-(4-methylphenyl)sulfonylpyridazin-3-yl]piperidine-4-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-1-[6-(4-methylphenyl)sulfonylpyridazin-3-yl]piperidine-4-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-1-[6-(p-tolylsulfonyl)pyridazin-3-yl]piperidine-4-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-1-[6-(4-methylphenyl)sulfonyl-3-pyridazinyl]-4-piperidinecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-1-[6-(4-methylphenyl)sulfonylpyridazin-3-yl]piperidine-4-carboxamide Traditional Name: N-(2-chlorobenzyl)-1-(6-tosylpyridazin-3-yl)isonipecotamide Formula: C24H25ClN4O3S MolecularWeight: 484.9983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=NN=C(C=C2)N3CCC(CC3)C(=O)NCC4=CC=CC=C4Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=NN=C(C=C2)N3CCC(CC3)C(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C24H25ClN4O3S/c1-17-6-8-20(9-7-17)33(31,32)23-11-10-22(27-28-23)29-14-12-18(13-15-29)24(30)26-16-19-4-2-3-5-21(19)25/h2-11,18H,12-16H2,1H3,(H,26,30)