9-[1-(3-hydroxyphenyl)ethyl]-3H-purine-6-thione

Systemtic Name: 9-[1-(3-hydroxyphenyl)ethyl]-3H-purine-6-thione Openeye Name: 9-[1-(3-hydroxyphenyl)ethyl]-3H-purine-6-thione CAS Name: 9-[1-(3-hydroxyphenyl)ethyl]-3H-purine-6-thione IUPAC Name: 9-[1-(3-hydroxyphenyl)ethyl]-3H-purine-6-thione Traditional Name: 9-[1-(3-hydroxyphenyl)ethyl]-3H-purine-6-thione Formula: C13H12N4OS MolecularWeight: 272.32558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)O)N2C=NC3=C2NC=NC3=S

Isomeric SMILES

CC(C1=CC(=CC=C1)O)N2C=NC3=C2NC=NC3=S

InChI

InChI=1S/C13H12N4OS/c1-8(9-3-2-4-10(18)5-9)17-7-16-11-12(17)14-6-15-13(11)19/h2-8,18H,1H3,(H,14,15,19)