4-[(4-azanyl-2-methylsulfanyl-pyrimidin-5-yl)diazenyl]-N-(1,3-thiazol-2-yl)benzenesulfonamide

Systemtic Name: 4-[(4-azanyl-2-methylsulfanyl-pyrimidin-5-yl)diazenyl]-N-(1,3-thiazol-2-yl)benzenesulfonamide Openeye Name: 4-(4-amino-2-methylsulfanyl-pyrimidin-5-yl)azo-N-thiazol-2-yl-benzenesulfonamide CAS Name: 4-[[4-amino-2-(methylthio)-5-pyrimidinyl]azo]-N-(2-thiazolyl)benzenesulfonamide IUPAC Name: 4-[(4-amino-2-methylsulfanylpyrimidin-5-yl)diazenyl]-N-(1,3-thiazol-2-yl)benzenesulfonamide Traditional Name: 4-[4-amino-2-(methylthio)pyrimidin-5-yl]azo-N-thiazol-2-yl-benzenesulfonamide Formula: C14H13N7O2S3 MolecularWeight: 407.49372

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)N)N=NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

Isomeric SMILES

CSC1=NC=C(C(=N1)N)N=NC2=CC=C(C=C2)S(=O)(=O)NC3=NC=CS3

InChI

InChI=1S/C14H13N7O2S3/c1-24-13-17-8-11(12(15)18-13)20-19-9-2-4-10(5-3-9)26(22,23)21-14-16-6-7-25-14/h2-8H,1H3,(H,16,21)(H2,15,17,18)