4-azanyl-N-pyrimidin-2-yl-3-[(4-sulfamoylphenyl)diazenyl]benzenesulfonamide

Systemtic Name: 4-azanyl-N-pyrimidin-2-yl-3-[(4-sulfamoylphenyl)diazenyl]benzenesulfonamide Openeye Name: 4-amino-N-pyrimidin-2-yl-3-(4-sulfamoylphenyl)azo-benzenesulfonamide CAS Name: 4-amino-N-(2-pyrimidinyl)-3-(4-sulfamoylphenyl)azobenzenesulfonamide IUPAC Name: 4-amino-N-pyrimidin-2-yl-3-[(4-sulfamoylphenyl)diazenyl]benzenesulfonamide Traditional Name: 4-amino-N-(2-pyrimidyl)-3-(4-sulfamoylphenyl)azo-benzenesulfonamide Formula: C16H15N7O4S2 MolecularWeight: 433.4648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NS(=O)(=O)C2=CC(=C(C=C2)N)N=NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC(=C(C=C2)N)N=NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C16H15N7O4S2/c17-14-7-6-13(29(26,27)23-16-19-8-1-9-20-16)10-15(14)22-21-11-2-4-12(5-3-11)28(18,24)25/h1-10H,17H2,(H2,18,24,25)(H,19,20,23)