4-oxidanyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-5-(phenylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 4-oxidanyl-2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-5-(phenylmethyl)-1H-pyrimidin-6-one Openeye Name: 5-benzyl-4-hydroxy-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-1H-pyrimidin-6-one CAS Name: 4-hydroxy-2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-5-(phenylmethyl)-1H-pyrimidin-6-one IUPAC Name: 5-benzyl-4-hydroxy-2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-1H-pyrimidin-6-one Traditional Name: 5-benzyl-4-hydroxy-2-[(2-keto-2-piperidino-ethyl)thio]-1H-pyrimidin-6-one Formula: C18H21N3O3S MolecularWeight: 359.44264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC(=C(C(=O)N2)CC3=CC=CC=C3)O

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NC(=C(C(=O)N2)CC3=CC=CC=C3)O

InChI

InChI=1S/C18H21N3O3S/c22-15(21-9-5-2-6-10-21)12-25-18-19-16(23)14(17(24)20-18)11-13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,9-12H2,(H2,19,20,23,24)