9-(4-nitrophenyl)sulfanyl-3H-purine-6-thione

Systemtic Name: 9-(4-nitrophenyl)sulfanyl-3H-purine-6-thione Openeye Name: 9-(4-nitrophenyl)sulfanyl-3H-purine-6-thione CAS Name: 9-[(4-nitrophenyl)thio]-3H-purine-6-thione IUPAC Name: 9-(4-nitrophenyl)sulfanyl-3H-purine-6-thione Traditional Name: 9-[(4-nitrophenyl)thio]-3H-purine-6-thione Formula: C11H7N5O2S2 MolecularWeight: 305.33558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])SN2C=NC3=C2NC=NC3=S

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])SN2C=NC3=C2NC=NC3=S

InChI

InChI=1S/C11H7N5O2S2/c17-16(18)7-1-3-8(4-2-7)20-15-6-14-9-10(15)12-5-13-11(9)19/h1-6H,(H,12,13,19)