N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(p-tolylsulfonyl)indol-1-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-methylphenyl)sulfonyl-1-indolyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[3-(4-methylphenyl)sulfonylindol-1-yl]acetamide Traditional Name: N-piperonyl-2-(3-tosylindol-1-yl)acetamide Formula: C25H22N2O5S MolecularWeight: 462.51758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H22N2O5S/c1-17-6-9-19(10-7-17)33(29,30)24-14-27(21-5-3-2-4-20(21)24)15-25(28)26-13-18-8-11-22-23(12-18)32-16-31-22/h2-12,14H,13,15-16H2,1H3,(H,26,28)