2-ethylsulfanyl-9-(phenylmethyl)purin-6-amine

Systemtic Name: 2-ethylsulfanyl-9-(phenylmethyl)purin-6-amine Openeye Name: 9-benzyl-2-ethylsulfanyl-purin-6-amine CAS Name: 2-(ethylthio)-9-(phenylmethyl)-6-purinamine IUPAC Name: 9-benzyl-2-ethylsulfanylpurin-6-amine Traditional Name: [9-benzyl-2-(ethylthio)purin-6-yl]amine Formula: C14H15N5S MolecularWeight: 285.3674

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C(=N1)N)N=CN2CC3=CC=CC=C3

Isomeric SMILES

CCSC1=NC2=C(C(=N1)N)N=CN2CC3=CC=CC=C3

InChI

InChI=1S/C14H15N5S/c1-2-20-14-17-12(15)11-13(18-14)19(9-16-11)8-10-6-4-3-5-7-10/h3-7,9H,2,8H2,1H3,(H2,15,17,18)