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

Systemtic Name: 6-ethyl-2-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]sulfanyl-1H-pyrimidin-4-one Openeye Name: 2-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-6-ethyl-1H-pyrimidin-4-one CAS Name: 6-ethyl-2-[[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]thio]-1H-pyrimidin-4-one IUPAC Name: 2-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]sulfanyl-6-ethyl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(4-benzylpiperidino)-2-keto-ethyl]thio]-6-ethyl-1H-pyrimidin-4-one Formula: C20H25N3O2S MolecularWeight: 371.4964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)SCC(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=O)N=C(N1)SCC(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O2S/c1-2-17-13-18(24)22-20(21-17)26-14-19(25)23-10-8-16(9-11-23)12-15-6-4-3-5-7-15/h3-7,13,16H,2,8-12,14H2,1H3,(H,21,22,24)