N-phenethyl-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-phenethyl-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-phenethyl-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-phenethyl-2-[[6-(1-pyrrolidinyl)-4-pyrimidinyl]thio]acetamide IUPAC Name: N-phenethyl-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-phenethyl-2-[(6-pyrrolidinopyrimidin-4-yl)thio]acetamide Formula: C18H22N4OS MolecularWeight: 342.45848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC=N2)SCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C2=CC(=NC=N2)SCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C18H22N4OS/c23-17(19-9-8-15-6-2-1-3-7-15)13-24-18-12-16(20-14-21-18)22-10-4-5-11-22/h1-3,6-7,12,14H,4-5,8-11,13H2,(H,19,23)