N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-fluorophenyl)methyl-methylsulfonyl-amino]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-fluorophenyl)methyl-methylsulfonylamino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(2-fluorophenyl)methyl-methylsulfonylamino]benzamide Traditional Name: 4-[(2-fluorobenzyl)-mesyl-amino]-N-piperonyl-benzamide Formula: C23H21FN2O5S MolecularWeight: 456.486643

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC1=CC=CC=C1F)C2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CS(=O)(=O)N(CC1=CC=CC=C1F)C2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H21FN2O5S/c1-32(28,29)26(14-18-4-2-3-5-20(18)24)19-9-7-17(8-10-19)23(27)25-13-16-6-11-21-22(12-16)31-15-30-21/h2-12H,13-15H2,1H3,(H,25,27)