2-fluoranyl-N-[(2-methoxyphenyl)methyl]-5-[(3S)-3-methylpiperidin-1-yl]sulfonyl-benzamide

Systemtic Name: 2-fluoranyl-N-[(2-methoxyphenyl)methyl]-5-[(3S)-3-methylpiperidin-1-yl]sulfonyl-benzamide Openeye Name: 2-fluoro-N-[(2-methoxyphenyl)methyl]-5-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzamide CAS Name: 2-fluoro-N-[(2-methoxyphenyl)methyl]-5-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]benzamide IUPAC Name: 2-fluoro-N-[(2-methoxyphenyl)methyl]-5-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzamide Traditional Name: 2-fluoro-5-[(3S)-3-methylpiperidino]sulfonyl-N-o-anisyl-benzamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NCC3=CC=CC=C3OC

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)F)C(=O)NCC3=CC=CC=C3OC

InChI

InChI=1S/C21H25FN2O4S/c1-15-6-5-11-24(14-15)29(26,27)17-9-10-19(22)18(12-17)21(25)23-13-16-7-3-4-8-20(16)28-2/h3-4,7-10,12,15H,5-6,11,13-14H2,1-2H3,(H,23,25)/t15-/m0/s1