2-tert-butyl-4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one

Systemtic Name: 2-tert-butyl-4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one Openeye Name: 2-tert-butyl-4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1,1-dioxo-5-phenyl-isothiazol-3-one CAS Name: 2-tert-butyl-4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1,1-dioxo-5-phenyl-3-isothiazolone IUPAC Name: 2-tert-butyl-4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1,1-dioxo-5-phenyl-1,2-thiazol-3-one Traditional Name: 2-tert-butyl-4-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-1,1-diketo-5-phenyl-isothiazol-3-one Formula: C22H24N2O5S MolecularWeight: 428.50136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NCC3COC4=CC=CC=C4O3

InChI

InChI=1S/C22H24N2O5S/c1-22(2,3)24-21(25)19(20(30(24,26)27)15-9-5-4-6-10-15)23-13-16-14-28-17-11-7-8-12-18(17)29-16/h4-12,16,23H,13-14H2,1-3H3