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

Systemtic Name: 2-(6-bromanyl-1-methyl-indol-3-yl)-2-(6-chloranyl-1,3-benzodioxol-5-yl)-N-(4-methylphenyl)sulfonyl-ethanamide Openeye Name: 2-(6-bromo-1-methyl-indol-3-yl)-2-(6-chloro-1,3-benzodioxol-5-yl)-N-(p-tolylsulfonyl)acetamide CAS Name: 2-(6-bromo-1-methyl-3-indolyl)-2-(6-chloro-1,3-benzodioxol-5-yl)-N-(4-methylphenyl)sulfonylacetamide IUPAC Name: 2-(6-bromo-1-methylindol-3-yl)-2-(6-chloro-1,3-benzodioxol-5-yl)-N-(4-methylphenyl)sulfonylacetamide Traditional Name: 2-(6-bromo-1-methyl-indol-3-yl)-2-(6-chloro-1,3-benzodioxol-5-yl)-N-tosyl-acetamide Formula: C25H20BrClN2O5S MolecularWeight: 575.8587

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C(C2=CC3=C(C=C2Cl)OCO3)C4=CN(C5=C4C=CC(=C5)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)C(C2=CC3=C(C=C2Cl)OCO3)C4=CN(C5=C4C=CC(=C5)Br)C

InChI

InChI=1S/C25H20BrClN2O5S/c1-14-3-6-16(7-4-14)35(31,32)28-25(30)24(18-10-22-23(11-20(18)27)34-13-33-22)19-12-29(2)21-9-15(26)5-8-17(19)21/h3-12,24H,13H2,1-2H3,(H,28,30)