6-[4-[(2-methyl-2-nitrososulfanyl-propyl)amino]pyrimidin-2-yl]sulfanylhexan-1-ol

Systemtic Name: 6-[4-[(2-methyl-2-nitrososulfanyl-propyl)amino]pyrimidin-2-yl]sulfanylhexan-1-ol Openeye Name: 6-[4-[(2-methyl-2-nitrososulfanyl-propyl)amino]pyrimidin-2-yl]sulfanylhexan-1-ol CAS Name: 1-[[2-(6-hydroxyhexylthio)-4-pyrimidinyl]amino]-2-methyl-N-oxo-2-propanesulfenamide IUPAC Name: 6-[4-[(2-methyl-2-nitrososulfanylpropyl)amino]pyrimidin-2-yl]sulfanylhexan-1-ol Traditional Name: 6-[[4-[[2-methyl-2-(nitrosothio)propyl]amino]pyrimidin-2-yl]thio]hexan-1-ol Formula: C14H24N4O2S2 MolecularWeight: 344.49596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=NC(=NC=C1)SCCCCCCO)SN=O

Isomeric SMILES

CC(C)(CNC1=NC(=NC=C1)SCCCCCCO)SN=O

InChI

InChI=1S/C14H24N4O2S2/c1-14(2,22-18-20)11-16-12-7-8-15-13(17-12)21-10-6-4-3-5-9-19/h7-8,19H,3-6,9-11H2,1-2H3,(H,15,16,17)