N-[2,3-bis(chloranyl)phenyl]-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[2,3-bis(chloranyl)phenyl]-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2,3-dichlorophenyl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(2,3-dichlorophenyl)-2-[[6-(1-pyrrolidinyl)-4-pyrimidinyl]thio]acetamide IUPAC Name: N-(2,3-dichlorophenyl)-2-(6-pyrrolidin-1-ylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(2,3-dichlorophenyl)-2-[(6-pyrrolidinopyrimidin-4-yl)thio]acetamide Formula: C16H16Cl2N4OS MolecularWeight: 383.29544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC=N2)SCC(=O)NC3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

C1CCN(C1)C2=CC(=NC=N2)SCC(=O)NC3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C16H16Cl2N4OS/c17-11-4-3-5-12(16(11)18)21-14(23)9-24-15-8-13(19-10-20-15)22-6-1-2-7-22/h3-5,8,10H,1-2,6-7,9H2,(H,21,23)