N-(4-bromophenyl)-3-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(4-bromophenyl)-3-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(4-bromophenyl)-3-(6-phenylpyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(4-bromophenyl)-3-[(6-phenyl-4-pyrimidinyl)thio]propanamide IUPAC Name: N-(4-bromophenyl)-3-(6-phenylpyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(4-bromophenyl)-3-[(6-phenylpyrimidin-4-yl)thio]propionamide Formula: C19H16BrN3OS MolecularWeight: 414.31884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC=N2)SCCC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC=N2)SCCC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H16BrN3OS/c20-15-6-8-16(9-7-15)23-18(24)10-11-25-19-12-17(21-13-22-19)14-4-2-1-3-5-14/h1-9,12-13H,10-11H2,(H,23,24)