N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-ethylphenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-ethylphenyl)-(4-methylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-ethyl-N-(p-tolylsulfonyl)anilino]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(2-ethyl-N-(4-methylphenyl)sulfonylanilino)acetamide Traditional Name: 2-(2-ethyl-N-tosyl-anilino)-N-piperonyl-acetamide Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N(CC(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1=CC=CC=C1N(CC(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H26N2O5S/c1-3-20-6-4-5-7-22(20)27(33(29,30)21-11-8-18(2)9-12-21)16-25(28)26-15-19-10-13-23-24(14-19)32-17-31-23/h4-14H,3,15-17H2,1-2H3,(H,26,28)