N-[2-tert-butyl-4-(3-oxidanylidenebutyl)-1,2-thiazol-5-ylidene]-5-chloranyl-2-methoxy-benzamide

Systemtic Name: N-[2-tert-butyl-4-(3-oxidanylidenebutyl)-1,2-thiazol-5-ylidene]-5-chloranyl-2-methoxy-benzamide Openeye Name: N-[2-tert-butyl-4-(3-oxobutyl)isothiazol-5-ylidene]-5-chloro-2-methoxy-benzamide CAS Name: N-[2-tert-butyl-4-(3-oxobutyl)-5-isothiazolylidene]-5-chloro-2-methoxybenzamide IUPAC Name: N-[2-tert-butyl-4-(3-oxobutyl)-1,2-thiazol-5-ylidene]-5-chloro-2-methoxybenzamide Traditional Name: N-[2-tert-butyl-4-(3-ketobutyl)-3-isothiazolin-5-ylidene]-5-chloro-2-methoxy-benzamide Formula: C19H23ClN2O3S MolecularWeight: 394.91552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CN(SC1=NC(=O)C2=C(C=CC(=C2)Cl)OC)C(C)(C)C

Isomeric SMILES

CC(=O)CCC1=CN(SC1=NC(=O)C2=C(C=CC(=C2)Cl)OC)C(C)(C)C

InChI

InChI=1S/C19H23ClN2O3S/c1-12(23)6-7-13-11-22(19(2,3)4)26-18(13)21-17(24)15-10-14(20)8-9-16(15)25-5/h8-11H,6-7H2,1-5H3