N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-(2-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-(2-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-[(2-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-4-[(2-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-(2-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-4-(2-methylpiperidino)sulfonyl-benzamide Formula: C22H27FN2O3S2 MolecularWeight: 450.589783

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3F

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3F

InChI

InChI=1S/C22H27FN2O3S2/c1-17-6-4-5-14-25(17)30(27,28)20-11-9-18(10-12-20)22(26)24-13-15-29-16-19-7-2-3-8-21(19)23/h2-3,7-12,17H,4-6,13-16H2,1H3,(H,24,26)