4-(1,3-benzothiazol-2-ylsulfanyldiazenyl)-N-pyrimidin-2-yl-benzenesulfonamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyldiazenyl)-N-pyrimidin-2-yl-benzenesulfonamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanylazo)-N-pyrimidin-2-yl-benzenesulfonamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)azo-N-(2-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyldiazenyl)-N-pyrimidin-2-ylbenzenesulfonamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)azo-N-(2-pyrimidyl)benzenesulfonamide Formula: C17H12N6O2S3 MolecularWeight: 428.51118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SN=NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SN=NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C17H12N6O2S3/c24-28(25,22-16-18-10-3-11-19-16)13-8-6-12(7-9-13)21-23-27-17-20-14-4-1-2-5-15(14)26-17/h1-11H,(H,18,19,22)