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

Systemtic Name: 6-[4-[(2-methyl-2-sulfanyl-propyl)amino]pyrimidin-2-yl]sulfanylhexan-1-ol Openeye Name: 6-[4-[(2-methyl-2-sulfanyl-propyl)amino]pyrimidin-2-yl]sulfanylhexan-1-ol CAS Name: 6-[[4-[(2-mercapto-2-methylpropyl)amino]-2-pyrimidinyl]thio]-1-hexanol IUPAC Name: 6-[4-[(2-methyl-2-sulfanylpropyl)amino]pyrimidin-2-yl]sulfanylhexan-1-ol Traditional Name: 6-[[4-[(2-mercapto-2-methyl-propyl)amino]pyrimidin-2-yl]thio]hexan-1-ol Formula: C14H25N3OS2 MolecularWeight: 315.4978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=NC(=NC=C1)SCCCCCCO)S

Isomeric SMILES

CC(C)(CNC1=NC(=NC=C1)SCCCCCCO)S

InChI

InChI=1S/C14H25N3OS2/c1-14(2,19)11-16-12-7-8-15-13(17-12)20-10-6-4-3-5-9-18/h7-8,18-19H,3-6,9-11H2,1-2H3,(H,15,16,17)