N-(3-methylbutyl)-2-methylsulfanyl-7H-purin-6-amine

Systemtic Name: N-(3-methylbutyl)-2-methylsulfanyl-7H-purin-6-amine Openeye Name: N-isopentyl-2-methylsulfanyl-7H-purin-6-amine CAS Name: N-(3-methylbutyl)-2-(methylthio)-7H-purin-6-amine IUPAC Name: N-(3-methylbutyl)-2-methylsulfanyl-7H-purin-6-amine Traditional Name: isoamyl-[2-(methylthio)-7H-purin-6-yl]amine Formula: C11H17N5S MolecularWeight: 251.35118

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC1=NC(=NC2=C1NC=N2)SC

Isomeric SMILES

CC(C)CCNC1=NC(=NC2=C1NC=N2)SC

InChI

InChI=1S/C11H17N5S/c1-7(2)4-5-12-9-8-10(14-6-13-8)16-11(15-9)17-3/h6-7H,4-5H2,1-3H3,(H2,12,13,14,15,16)