N-cyclopropyl-N-[(4-fluorophenyl)methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-cyclopropyl-N-[(4-fluorophenyl)methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-cyclopropyl-N-[(4-fluorophenyl)methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-cyclopropyl-N-[(4-fluorophenyl)methyl]-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-cyclopropyl-N-[(4-fluorophenyl)methyl]-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-cyclopropyl-N-(4-fluorobenzyl)-1-mesitylsulfonyl-isonipecotamide Formula: C25H31FN2O3S MolecularWeight: 458.588643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)N(CC3=CC=C(C=C3)F)C4CC4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)N(CC3=CC=C(C=C3)F)C4CC4)C

InChI

InChI=1S/C25H31FN2O3S/c1-17-14-18(2)24(19(3)15-17)32(30,31)27-12-10-21(11-13-27)25(29)28(23-8-9-23)16-20-4-6-22(26)7-5-20/h4-7,14-15,21,23H,8-13,16H2,1-3H3