N-(3-phenylpropyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-phenylpropyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-phenylpropyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-phenylpropyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-phenylpropyl)-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-phenylpropyl)-1-(2,3,5,6-tetramethylphenyl)sulfonyl-isonipecotamide Formula: C25H34N2O3S MolecularWeight: 442.61406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NCCCC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)S(=O)(=O)N2CCC(CC2)C(=O)NCCCC3=CC=CC=C3)C)C

InChI

InChI=1S/C25H34N2O3S/c1-18-17-19(2)21(4)24(20(18)3)31(29,30)27-15-12-23(13-16-27)25(28)26-14-8-11-22-9-6-5-7-10-22/h5-7,9-10,17,23H,8,11-16H2,1-4H3,(H,26,28)