2-[2-(2-tert-butyl-4-ethyl-phenoxy)ethoxy]-5-chloranyl-benzenecarbothioamide

Systemtic Name: 2-[2-(2-tert-butyl-4-ethyl-phenoxy)ethoxy]-5-chloranyl-benzenecarbothioamide Openeye Name: 2-[2-(2-tert-butyl-4-ethyl-phenoxy)ethoxy]-5-chloro-benzenecarbothioamide CAS Name: 2-[2-(2-tert-butyl-4-ethylphenoxy)ethoxy]-5-chlorobenzenecarbothioamide IUPAC Name: 2-[2-(2-tert-butyl-4-ethylphenoxy)ethoxy]-5-chlorobenzenecarbothioamide Traditional Name: 2-[2-(2-tert-butyl-4-ethyl-phenoxy)ethoxy]-5-chloro-thiobenzamide Formula: C21H26ClNO2S MolecularWeight: 391.95464

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCCOC2=C(C=C(C=C2)Cl)C(=S)N)C(C)(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1)OCCOC2=C(C=C(C=C2)Cl)C(=S)N)C(C)(C)C

InChI

InChI=1S/C21H26ClNO2S/c1-5-14-6-8-19(17(12-14)21(2,3)4)25-11-10-24-18-9-7-15(22)13-16(18)20(23)26/h6-9,12-13H,5,10-11H2,1-4H3,(H2,23,26)