3-(4,6-diphenylpyrimidin-2-yl)sulfanyl-1-piperidin-1-yl-propan-1-one

Systemtic Name: 3-(4,6-diphenylpyrimidin-2-yl)sulfanyl-1-piperidin-1-yl-propan-1-one Openeye Name: 3-(4,6-diphenylpyrimidin-2-yl)sulfanyl-1-(1-piperidyl)propan-1-one CAS Name: 3-[(4,6-diphenyl-2-pyrimidinyl)thio]-1-(1-piperidinyl)-1-propanone IUPAC Name: 3-(4,6-diphenylpyrimidin-2-yl)sulfanyl-1-piperidin-1-ylpropan-1-one Traditional Name: 3-[(4,6-diphenylpyrimidin-2-yl)thio]-1-piperidino-propan-1-one Formula: C24H25N3OS MolecularWeight: 403.5398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CCSC2=NC(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CCSC2=NC(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H25N3OS/c28-23(27-15-8-3-9-16-27)14-17-29-24-25-21(19-10-4-1-5-11-19)18-22(26-24)20-12-6-2-7-13-20/h1-2,4-7,10-13,18H,3,8-9,14-17H2