[3-(2-methylsulfanylimidazol-1-yl)phenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [3-(2-methylsulfanylimidazol-1-yl)phenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [3-(2-methylsulfanylimidazol-1-yl)phenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [3-[2-(methylthio)-1-imidazolyl]phenyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [3-(2-methylsulfanylimidazol-1-yl)phenyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [3-[2-(methylthio)imidazol-1-yl]phenyl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C19H20N6OS MolecularWeight: 380.4667

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CN1C2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CSC1=NC=CN1C2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C19H20N6OS/c1-27-19-22-8-9-25(19)16-5-2-4-15(14-16)17(26)23-10-12-24(13-11-23)18-20-6-3-7-21-18/h2-9,14H,10-13H2,1H3