3-chloranyl-5-ethoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]benzenecarbothioamide

Systemtic Name: 3-chloranyl-5-ethoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]benzenecarbothioamide Openeye Name: 4-[2-(2-allylphenoxy)ethoxy]-3-chloro-5-ethoxy-benzenecarbothioamide CAS Name: 3-chloro-5-ethoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]benzenecarbothioamide IUPAC Name: 3-chloro-5-ethoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]benzenecarbothioamide Traditional Name: 4-[2-(2-allylphenoxy)ethoxy]-3-chloro-5-ethoxy-thiobenzamide Formula: C20H22ClNO3S MolecularWeight: 391.91158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=S)N)Cl)OCCOC2=CC=CC=C2CC=C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=S)N)Cl)OCCOC2=CC=CC=C2CC=C

InChI

InChI=1S/C20H22ClNO3S/c1-3-7-14-8-5-6-9-17(14)24-10-11-25-19-16(21)12-15(20(22)26)13-18(19)23-4-2/h3,5-6,8-9,12-13H,1,4,7,10-11H2,2H3,(H2,22,26)