4-[(2-azanyl-6-sulfanylidene-3,5-dihydropurin-8-yl)diazenyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide

Systemtic Name: 4-[(2-azanyl-6-sulfanylidene-3,5-dihydropurin-8-yl)diazenyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Openeye Name: 4-[(2-amino-6-thioxo-3,5-dihydropurin-8-yl)azo]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide CAS Name: 4-[(2-amino-6-sulfanylidene-3,5-dihydropurin-8-yl)azo]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide IUPAC Name: 4-[(2-amino-6-sulfanylidene-3,5-dihydropurin-8-yl)diazenyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Traditional Name: 4-[(2-amino-6-thioxo-3,5-dihydropurin-8-yl)azo]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzenesulfonamide Formula: C14H12N10O2S3 MolecularWeight: 448.50588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)N=NC3=NC4C(=N3)NC(=NC4=S)N

Isomeric SMILES

CC1=NN=C(S1)NS(=O)(=O)C2=CC=C(C=C2)N=NC3=NC4C(=N3)NC(=NC4=S)N

InChI

InChI=1S/C14H12N10O2S3/c1-6-20-23-14(28-6)24-29(25,26)8-4-2-7(3-5-8)21-22-13-16-9-10(18-13)17-12(15)19-11(9)27/h2-5,9H,1H3,(H,23,24)(H3,15,16,17,18,19,27)