10-(4-methoxyphenyl)-7-(2-pyrimidin-2-ylsulfanylethanoyl)-7,10-diazaspiro[4.5]decan-9-one

Systemtic Name: 10-(4-methoxyphenyl)-7-(2-pyrimidin-2-ylsulfanylethanoyl)-7,10-diazaspiro[4.5]decan-9-one Openeye Name: 10-(4-methoxyphenyl)-7-(2-pyrimidin-2-ylsulfanylacetyl)-7,10-diazaspiro[4.5]decan-9-one CAS Name: 10-(4-methoxyphenyl)-7-[1-oxo-2-(2-pyrimidinylthio)ethyl]-7,10-diazaspiro[4.5]decan-9-one IUPAC Name: 10-(4-methoxyphenyl)-7-(2-pyrimidin-2-ylsulfanylacetyl)-7,10-diazaspiro[4.5]decan-9-one Traditional Name: 10-(4-methoxyphenyl)-7-[2-(2-pyrimidylthio)acetyl]-7,10-diazaspiro[4.5]decan-9-one Formula: C21H24N4O3S MolecularWeight: 412.50526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)CN(CC23CCCC3)C(=O)CSC4=NC=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)CN(CC23CCCC3)C(=O)CSC4=NC=CC=N4

InChI

InChI=1S/C21H24N4O3S/c1-28-17-7-5-16(6-8-17)25-18(26)13-24(15-21(25)9-2-3-10-21)19(27)14-29-20-22-11-4-12-23-20/h4-8,11-12H,2-3,9-10,13-15H2,1H3