N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]propanamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-3-[(4-methylphenyl)-(4-methylphenyl)sulfonyl-amino]propanamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-[4-methyl-N-(p-tolylsulfonyl)anilino]propanamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)propanamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-methyl-N-(4-methylphenyl)sulfonylanilino)propanamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(4-methyl-N-tosyl-anilino)propionamide Formula: C25H25BrN2O5S MolecularWeight: 545.4454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCC(=O)NC2=CC3=C(C=C2Br)OCCO3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CCC(=O)NC2=CC3=C(C=C2Br)OCCO3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H25BrN2O5S/c1-17-3-7-19(8-4-17)28(34(30,31)20-9-5-18(2)6-10-20)12-11-25(29)27-22-16-24-23(15-21(22)26)32-13-14-33-24/h3-10,15-16H,11-14H2,1-2H3,(H,27,29)