N-(3,5-dimethylphenyl)-2-(2-ethoxy-4-pyrrolidin-1-ylcarbothioyl-phenoxy)ethanamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-(2-ethoxy-4-pyrrolidin-1-ylcarbothioyl-phenoxy)ethanamide Openeye Name: N-(3,5-dimethylphenyl)-2-[2-ethoxy-4-(pyrrolidine-1-carbothioyl)phenoxy]acetamide CAS Name: N-(3,5-dimethylphenyl)-2-[2-ethoxy-4-[1-pyrrolidinyl(sulfanylidene)methyl]phenoxy]acetamide IUPAC Name: N-(3,5-dimethylphenyl)-2-[2-ethoxy-4-(pyrrolidine-1-carbothioyl)phenoxy]acetamide Traditional Name: N-(3,5-dimethylphenyl)-2-[2-ethoxy-4-(pyrrolidine-1-carbothioyl)phenoxy]acetamide Formula: C23H28N2O3S MolecularWeight: 412.54502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=S)N2CCCC2)OCC(=O)NC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=S)N2CCCC2)OCC(=O)NC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C23H28N2O3S/c1-4-27-21-14-18(23(29)25-9-5-6-10-25)7-8-20(21)28-15-22(26)24-19-12-16(2)11-17(3)13-19/h7-8,11-14H,4-6,9-10,15H2,1-3H3,(H,24,26)