N-[2-(propylcarbamoyl)phenyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(propylcarbamoyl)phenyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(propylcarbamoyl)phenyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-[oxo(propylamino)methyl]phenyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(propylcarbamoyl)phenyl]-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(propylcarbamoyl)phenyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-isonipecotamide Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C(=CC(=C3C)C)C)C

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C(=CC(=C3C)C)C)C

InChI

InChI=1S/C26H35N3O4S/c1-6-13-27-26(31)22-9-7-8-10-23(22)28-25(30)21-11-14-29(15-12-21)34(32,33)24-19(4)17(2)16-18(3)20(24)5/h7-10,16,21H,6,11-15H2,1-5H3,(H,27,31)(H,28,30)