6-[[3-[(6-butan-2-yloxy-2-butan-2-ylsulfanyl-5-ethyl-pyrimidin-4-yl)methyl]phenyl]methyl]-2-butan-2-ylsulfanyl-5-ethyl-1H-pyrimidin-4-one

Systemtic Name: 6-[[3-[(6-butan-2-yloxy-2-butan-2-ylsulfanyl-5-ethyl-pyrimidin-4-yl)methyl]phenyl]methyl]-2-butan-2-ylsulfanyl-5-ethyl-1H-pyrimidin-4-one Openeye Name: 5-ethyl-6-[[3-[(5-ethyl-6-sec-butoxy-2-sec-butylsulfanyl-pyrimidin-4-yl)methyl]phenyl]methyl]-2-sec-butylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-[[3-[[6-butan-2-yloxy-2-(butan-2-ylthio)-5-ethyl-4-pyrimidinyl]methyl]phenyl]methyl]-2-(butan-2-ylthio)-5-ethyl-1H-pyrimidin-4-one IUPAC Name: 6-[[3-[(6-butan-2-yloxy-2-butan-2-ylsulfanyl-5-ethylpyrimidin-4-yl)methyl]phenyl]methyl]-2-butan-2-ylsulfanyl-5-ethyl-1H-pyrimidin-4-one Traditional Name: 5-ethyl-6-[3-[[5-ethyl-6-sec-butoxy-2-(sec-butylthio)pyrimidin-4-yl]methyl]benzyl]-2-(sec-butylthio)-1H-pyrimidin-4-one Formula: C32H46N4O2S2 MolecularWeight: 582.86324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SC(C)CC)CC2=CC=CC(=C2)CC3=C(C(=NC(=N3)SC(C)CC)OC(C)CC)CC

Isomeric SMILES

CCC1=C(NC(=NC1=O)SC(C)CC)CC2=CC=CC(=C2)CC3=C(C(=NC(=N3)SC(C)CC)OC(C)CC)CC

InChI

InChI=1S/C32H46N4O2S2/c1-9-20(6)38-30-26(13-5)28(34-32(36-30)40-22(8)11-3)19-24-16-14-15-23(17-24)18-27-25(12-4)29(37)35-31(33-27)39-21(7)10-2/h14-17,20-22H,9-13,18-19H2,1-8H3,(H,33,35,37)