N-(3-methylsulfonylphenyl)-1-(2-phenylethanoyl)piperidine-3-carboxamide

Systemtic Name: N-(3-methylsulfonylphenyl)-1-(2-phenylethanoyl)piperidine-3-carboxamide Openeye Name: N-(3-methylsulfonylphenyl)-1-(2-phenylacetyl)piperidine-3-carboxamide CAS Name: N-(3-methylsulfonylphenyl)-1-(1-oxo-2-phenylethyl)-3-piperidinecarboxamide IUPAC Name: N-(3-methylsulfonylphenyl)-1-(2-phenylacetyl)piperidine-3-carboxamide Traditional Name: N-(3-mesylphenyl)-1-(2-phenylacetyl)nipecotamide Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2CCCN(C2)C(=O)CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)C2CCCN(C2)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O4S/c1-28(26,27)19-11-5-10-18(14-19)22-21(25)17-9-6-12-23(15-17)20(24)13-16-7-3-2-4-8-16/h2-5,7-8,10-11,14,17H,6,9,12-13,15H2,1H3,(H,22,25)