N-(3-chloranyl-4-cyano-phenyl)-1-methylsulfonyl-piperidine-2-carboxamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-1-methylsulfonyl-piperidine-2-carboxamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-1-methylsulfonyl-piperidine-2-carboxamide CAS Name: N-(3-chloro-4-cyanophenyl)-1-methylsulfonyl-2-piperidinecarboxamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-1-methylsulfonylpiperidine-2-carboxamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-1-mesyl-pipecolinamide Formula: C14H16ClN3O3S MolecularWeight: 341.81314

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCCC1C(=O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

CS(=O)(=O)N1CCCCC1C(=O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C14H16ClN3O3S/c1-22(20,21)18-7-3-2-4-13(18)14(19)17-11-6-5-10(9-16)12(15)8-11/h5-6,8,13H,2-4,7H2,1H3,(H,17,19)