2-(2-bromanyl-4-ethyl-phenoxy)-N-pyrrolidin-1-ylcarbothioyl-ethanamide

Systemtic Name: 2-(2-bromanyl-4-ethyl-phenoxy)-N-pyrrolidin-1-ylcarbothioyl-ethanamide Openeye Name: 2-(2-bromo-4-ethyl-phenoxy)-N-(pyrrolidine-1-carbothioyl)acetamide CAS Name: 2-(2-bromo-4-ethylphenoxy)-N-[1-pyrrolidinyl(sulfanylidene)methyl]acetamide IUPAC Name: 2-(2-bromo-4-ethylphenoxy)-N-(pyrrolidine-1-carbothioyl)acetamide Traditional Name: 2-(2-bromo-4-ethyl-phenoxy)-N-(pyrrolidine-1-carbothioyl)acetamide Formula: C15H19BrN2O2S MolecularWeight: 371.29256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)N2CCCC2)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCC(=O)NC(=S)N2CCCC2)Br

InChI

InChI=1S/C15H19BrN2O2S/c1-2-11-5-6-13(12(16)9-11)20-10-14(19)17-15(21)18-7-3-4-8-18/h5-6,9H,2-4,7-8,10H2,1H3,(H,17,19,21)