N-[2-(4-chlorophenyl)ethyl]-2-methylsulfanyl-4-phenyl-pyrimidine-5-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-2-methylsulfanyl-4-phenyl-pyrimidine-5-carboxamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-2-methylsulfanyl-4-phenyl-pyrimidine-5-carboxamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-2-(methylthio)-4-phenyl-5-pyrimidinecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-2-methylsulfanyl-4-phenylpyrimidine-5-carboxamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-2-(methylthio)-4-phenyl-pyrimidine-5-carboxamide Formula: C20H18ClN3OS MolecularWeight: 383.89442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C2=CC=CC=C2)C(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C2=CC=CC=C2)C(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClN3OS/c1-26-20-23-13-17(18(24-20)15-5-3-2-4-6-15)19(25)22-12-11-14-7-9-16(21)10-8-14/h2-10,13H,11-12H2,1H3,(H,22,25)