4-[[(3-bromanylphenoxy)-tert-butyl-(5-methylfuran-2-yl)-$l^{5}-phosphanylidene]amino]benzenesulfonamide

Systemtic Name: 4-[[(3-bromanylphenoxy)-tert-butyl-(5-methylfuran-2-yl)-$l^{5}-phosphanylidene]amino]benzenesulfonamide Openeye Name: 4-[[(3-bromophenoxy)-tert-butyl-(5-methyl-2-furyl)-$l^{5}-phosphanylidene]amino]benzenesulfonamide CAS Name: 4-[[(3-bromophenoxy)-tert-butyl-(5-methyl-2-furanyl)phosphoranylidene]amino]benzenesulfonamide IUPAC Name: 4-[[(3-bromophenoxy)-tert-butyl-(5-methylfuran-2-yl)-$l^{5}-phosphanylidene]amino]benzenesulfonamide Traditional Name: 4-[[(3-bromophenoxy)-tert-butyl-(5-methyl-2-furyl)phosphoranylidene]amino]benzenesulfonamide Formula: C21H24BrN2O4PS MolecularWeight: 511.369021

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)P(=NC2=CC=C(C=C2)S(=O)(=O)N)(C(C)(C)C)OC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC=C(O1)[P@](=NC2=CC=C(C=C2)S(=O)(=O)N)(C(C)(C)C)OC3=CC(=CC=C3)Br

InChI

InChI=1S/C21H24BrN2O4PS/c1-15-8-13-20(27-15)29(21(2,3)4,28-18-7-5-6-16(22)14-18)24-17-9-11-19(12-10-17)30(23,25)26/h5-14H,1-4H3,(H2,23,25,26)/t29-/m1/s1