3-(cyclopent-3-en-1-ylmethyl)-5-ethyl-6-phenylsulfanyl-1H-pyrimidine-2,4-dione

Systemtic Name: 3-(cyclopent-3-en-1-ylmethyl)-5-ethyl-6-phenylsulfanyl-1H-pyrimidine-2,4-dione Openeye Name: 3-(cyclopent-3-en-1-ylmethyl)-5-ethyl-6-phenylsulfanyl-1H-pyrimidine-2,4-dione CAS Name: 3-(1-cyclopent-3-enylmethyl)-5-ethyl-6-(phenylthio)-1H-pyrimidine-2,4-dione IUPAC Name: 3-(cyclopent-3-en-1-ylmethyl)-5-ethyl-6-phenylsulfanyl-1H-pyrimidine-2,4-dione Traditional Name: 3-(cyclopent-3-en-1-ylmethyl)-5-ethyl-6-(phenylthio)uracil Formula: C18H20N2O2S MolecularWeight: 328.4286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=O)N(C1=O)CC2CC=CC2)SC3=CC=CC=C3

Isomeric SMILES

CCC1=C(NC(=O)N(C1=O)CC2CC=CC2)SC3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2S/c1-2-15-16(23-14-10-4-3-5-11-14)19-18(22)20(17(15)21)12-13-8-6-7-9-13/h3-7,10-11,13H,2,8-9,12H2,1H3,(H,19,22)