4-[(2-azanyl-6-sulfanylidene-3,5-dihydropurin-8-yl)diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-[(2-azanyl-6-sulfanylidene-3,5-dihydropurin-8-yl)diazenyl]-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-[(2-amino-6-thioxo-3,5-dihydropurin-8-yl)azo]-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-[(2-amino-6-sulfanylidene-3,5-dihydropurin-8-yl)azo]-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[(2-amino-6-sulfanylidene-3,5-dihydropurin-8-yl)diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-[(2-amino-6-thioxo-3,5-dihydropurin-8-yl)azo]-N-(2-pyrimidyl)benzenesulfonamide Formula: C15H12N10O2S2 MolecularWeight: 428.45158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N=NC3=NC4C(=N3)NC(=NC4=S)N

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)N=NC3=NC4C(=N3)NC(=NC4=S)N

InChI

InChI=1S/C15H12N10O2S2/c16-13-20-11-10(12(28)22-13)19-15(21-11)24-23-8-2-4-9(5-3-8)29(26,27)25-14-17-6-1-7-18-14/h1-7,10H,(H,17,18,25)(H3,16,19,20,21,22,28)