3-methoxy-4-[2-(5-methyl-2-propan-2-yl-phenoxy)ethoxy]benzenecarbothioamide

Systemtic Name: 3-methoxy-4-[2-(5-methyl-2-propan-2-yl-phenoxy)ethoxy]benzenecarbothioamide Openeye Name: 4-[2-(2-isopropyl-5-methyl-phenoxy)ethoxy]-3-methoxy-benzenecarbothioamide CAS Name: 3-methoxy-4-[2-(5-methyl-2-propan-2-ylphenoxy)ethoxy]benzenecarbothioamide IUPAC Name: 3-methoxy-4-[2-(5-methyl-2-propan-2-ylphenoxy)ethoxy]benzenecarbothioamide Traditional Name: 4-[2-(2-isopropyl-5-methyl-phenoxy)ethoxy]-3-methoxy-thiobenzamide Formula: C20H25NO3S MolecularWeight: 359.4824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCCOC2=C(C=C(C=C2)C(=S)N)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCCOC2=C(C=C(C=C2)C(=S)N)OC

InChI

InChI=1S/C20H25NO3S/c1-13(2)16-7-5-14(3)11-18(16)24-10-9-23-17-8-6-15(20(21)25)12-19(17)22-4/h5-8,11-13H,9-10H2,1-4H3,(H2,21,25)