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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(3-methyl-N-methylsulfonyl-anilino)methyl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(3-methyl-N-methylsulfonylanilino)methyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[(3-methyl-N-methylsulfonylanilino)methyl]benzamide Traditional Name: 4-[(N-mesyl-3-methyl-anilino)methyl]-N-piperonyl-benzamide Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)S(=O)(=O)C

InChI

InChI=1S/C24H24N2O5S/c1-17-4-3-5-21(12-17)26(32(2,28)29)15-18-6-9-20(10-7-18)24(27)25-14-19-8-11-22-23(13-19)31-16-30-22/h3-13H,14-16H2,1-2H3,(H,25,27)