2-methylsulfanyl-N-pentyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: 2-methylsulfanyl-N-pentyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 2-methylsulfanyl-N-pentyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: 2-(methylthio)-N-pentyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine IUPAC Name: 2-methylsulfanyl-N-pentyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: amyl-[2-(methylthio)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amine Formula: C12H18N4S MolecularWeight: 250.36312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=NC(=NC2=C1C=CN2)SC

Isomeric SMILES

CCCCCNC1=NC(=NC2=C1C=CN2)SC

InChI

InChI=1S/C12H18N4S/c1-3-4-5-7-13-10-9-6-8-14-11(9)16-12(15-10)17-2/h6,8H,3-5,7H2,1-2H3,(H2,13,14,15,16)