5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-(4-fluorophenyl)sulfanyl-N-[(4-methylphenyl)methyl]benzamide

Systemtic Name: 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-(4-fluorophenyl)sulfanyl-N-[(4-methylphenyl)methyl]benzamide Openeye Name: 5-[(3,5-dimethyl-1-piperidyl)sulfonyl]-2-(4-fluorophenyl)sulfanyl-N-(p-tolylmethyl)benzamide CAS Name: 5-[(3,5-dimethyl-1-piperidinyl)sulfonyl]-2-[(4-fluorophenyl)thio]-N-[(4-methylphenyl)methyl]benzamide IUPAC Name: 5-(3,5-dimethylpiperidin-1-yl)sulfonyl-2-(4-fluorophenyl)sulfanyl-N-[(4-methylphenyl)methyl]benzamide Traditional Name: 5-(3,5-dimethylpiperidino)sulfonyl-2-[(4-fluorophenyl)thio]-N-(4-methylbenzyl)benzamide Formula: C28H31FN2O3S2 MolecularWeight: 526.685743

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)F)C(=O)NCC4=CC=C(C=C4)C)C

Isomeric SMILES

CC1CC(CN(C1)S(=O)(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)F)C(=O)NCC4=CC=C(C=C4)C)C

InChI

InChI=1S/C28H31FN2O3S2/c1-19-4-6-22(7-5-19)16-30-28(32)26-15-25(36(33,34)31-17-20(2)14-21(3)18-31)12-13-27(26)35-24-10-8-23(29)9-11-24/h4-13,15,20-21H,14,16-18H2,1-3H3,(H,30,32)