3-chloranyl-5-ethoxy-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzenecarbothioamide

Systemtic Name: 3-chloranyl-5-ethoxy-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzenecarbothioamide Openeye Name: 3-chloro-5-ethoxy-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzenecarbothioamide CAS Name: 3-chloro-5-ethoxy-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzenecarbothioamide IUPAC Name: 3-chloro-5-ethoxy-4-[2-(2,3,6-trimethylphenoxy)ethoxy]benzenecarbothioamide Traditional Name: 3-chloro-5-ethoxy-4-[2-(2,3,6-trimethylphenoxy)ethoxy]thiobenzamide Formula: C20H24ClNO3S MolecularWeight: 393.92746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=S)N)Cl)OCCOC2=C(C=CC(=C2C)C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=S)N)Cl)OCCOC2=C(C=CC(=C2C)C)C

InChI

InChI=1S/C20H24ClNO3S/c1-5-23-17-11-15(20(22)26)10-16(21)19(17)25-9-8-24-18-13(3)7-6-12(2)14(18)4/h6-7,10-11H,5,8-9H2,1-4H3,(H2,22,26)