2-(1,3-benzodioxol-5-yl)-N-(4-methylphenyl)sulfonyl-2-(1-methyl-6-pyridin-2-ylcarbonyl-indol-3-yl)ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-(4-methylphenyl)sulfonyl-2-(1-methyl-6-pyridin-2-ylcarbonyl-indol-3-yl)ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-2-[1-methyl-6-(pyridine-2-carbonyl)indol-3-yl]-N-(p-tolylsulfonyl)acetamide CAS Name: 2-(1,3-benzodioxol-5-yl)-2-[1-methyl-6-[oxo(2-pyridinyl)methyl]-3-indolyl]-N-(4-methylphenyl)sulfonylacetamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-(4-methylphenyl)sulfonyl-2-[1-methyl-6-(pyridine-2-carbonyl)indol-3-yl]acetamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-(1-methyl-6-picolinoyl-indol-3-yl)-N-tosyl-acetamide Formula: C31H25N3O6S MolecularWeight: 567.6117

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C(C2=CC3=C(C=C2)OCO3)C4=CN(C5=C4C=CC(=C5)C(=O)C6=CC=CC=N6)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C(C2=CC3=C(C=C2)OCO3)C4=CN(C5=C4C=CC(=C5)C(=O)C6=CC=CC=N6)C

InChI

InChI=1S/C31H25N3O6S/c1-19-6-10-22(11-7-19)41(37,38)33-31(36)29(20-9-13-27-28(16-20)40-18-39-27)24-17-34(2)26-15-21(8-12-23(24)26)30(35)25-5-3-4-14-32-25/h3-17,29H,18H2,1-2H3,(H,33,36)