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

Systemtic Name: N-[2-tert-butyl-4-(4-cyanobutyl)-1,2-thiazol-5-ylidene]-5-chloranyl-2-methoxy-benzamide Openeye Name: N-[2-tert-butyl-4-(4-cyanobutyl)isothiazol-5-ylidene]-5-chloro-2-methoxy-benzamide CAS Name: N-[2-tert-butyl-4-(4-cyanobutyl)-5-isothiazolylidene]-5-chloro-2-methoxybenzamide IUPAC Name: N-[2-tert-butyl-4-(4-cyanobutyl)-1,2-thiazol-5-ylidene]-5-chloro-2-methoxybenzamide Traditional Name: N-[2-tert-butyl-4-(4-cyanobutyl)-3-isothiazolin-5-ylidene]-5-chloro-2-methoxy-benzamide Formula: C20H24ClN3O2S MolecularWeight: 405.94146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=NC(=O)C2=C(C=CC(=C2)Cl)OC)S1)CCCCC#N

Isomeric SMILES

CC(C)(C)N1C=C(C(=NC(=O)C2=C(C=CC(=C2)Cl)OC)S1)CCCCC#N

InChI

InChI=1S/C20H24ClN3O2S/c1-20(2,3)24-13-14(8-6-5-7-11-22)19(27-24)23-18(25)16-12-15(21)9-10-17(16)26-4/h9-10,12-13H,5-8H2,1-4H3