4-[2-(2-tert-butyl-4-ethyl-phenoxy)ethoxy]-3-methoxy-benzenecarbothioamide

Systemtic Name: 4-[2-(2-tert-butyl-4-ethyl-phenoxy)ethoxy]-3-methoxy-benzenecarbothioamide Openeye Name: 4-[2-(2-tert-butyl-4-ethyl-phenoxy)ethoxy]-3-methoxy-benzenecarbothioamide CAS Name: 4-[2-(2-tert-butyl-4-ethylphenoxy)ethoxy]-3-methoxybenzenecarbothioamide IUPAC Name: 4-[2-(2-tert-butyl-4-ethylphenoxy)ethoxy]-3-methoxybenzenecarbothioamide Traditional Name: 4-[2-(2-tert-butyl-4-ethyl-phenoxy)ethoxy]-3-methoxy-thiobenzamide Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29NO3S/c1-6-15-7-9-18(17(13-15)22(2,3)4)25-11-12-26-19-10-8-16(21(23)27)14-20(19)24-5/h7-10,13-14H,6,11-12H2,1-5H3,(H2,23,27)