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

Systemtic Name: 2-tert-butyl-1,1-bis(oxidanylidene)-4-(3-oxidanylpropylamino)-5-phenyl-1,2-thiazol-3-one Openeye Name: 2-tert-butyl-4-(3-hydroxypropylamino)-1,1-dioxo-5-phenyl-isothiazol-3-one CAS Name: 2-tert-butyl-4-(3-hydroxypropylamino)-1,1-dioxo-5-phenyl-3-isothiazolone IUPAC Name: 2-tert-butyl-4-(3-hydroxypropylamino)-1,1-dioxo-5-phenyl-1,2-thiazol-3-one Traditional Name: 2-tert-butyl-4-(3-hydroxypropylamino)-1,1-diketo-5-phenyl-isothiazol-3-one Formula: C16H22N2O4S MolecularWeight: 338.42188

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)NCCCO

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(S1(=O)=O)C2=CC=CC=C2)NCCCO

InChI

InChI=1S/C16H22N2O4S/c1-16(2,3)18-15(20)13(17-10-7-11-19)14(23(18,21)22)12-8-5-4-6-9-12/h4-6,8-9,17,19H,7,10-11H2,1-3H3