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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[(4-fluorophenyl)sulfonyl-methyl-amino]ethanoylamino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetyl]amino]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[(4-fluorophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-[(4-fluorophenyl)sulfonyl-methylamino]acetyl]amino]benzamide Traditional Name: 2-[[2-[(4-fluorophenyl)sulfonyl-methyl-amino]acetyl]amino]-N-piperonyl-benzamide Formula: C24H22FN3O6S MolecularWeight: 499.511383

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H22FN3O6S/c1-28(35(31,32)18-9-7-17(25)8-10-18)14-23(29)27-20-5-3-2-4-19(20)24(30)26-13-16-6-11-21-22(12-16)34-15-33-21/h2-12H,13-15H2,1H3,(H,26,30)(H,27,29)