[4-[[(4-tert-butylphenyl)sulfonylamino]carbamothioylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide

Systemtic Name: [4-[[(4-tert-butylphenyl)sulfonylamino]carbamothioylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide Openeye Name: [4-[[(4-tert-butylphenyl)sulfonylamino]carbamothioylamino]phenyl]sulfonyl-pyrimidin-2-yl-azanide CAS Name: [4-[[[(4-tert-butylphenyl)sulfonylhydrazo]-sulfanylidenemethyl]amino]phenyl]sulfonyl-(2-pyrimidinyl)azanide IUPAC Name: [4-[[(4-tert-butylphenyl)sulfonylamino]carbamothioylamino]phenyl]sulfonyl-pyrimidin-2-ylazanide Traditional Name: [4-[[(4-tert-butylphenyl)sulfonylamino]thiocarbamoylamino]phenyl]sulfonyl-(2-pyrimidyl)azanide Formula: C21H23N6O4S3- MolecularWeight: 519.64012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NNC(=S)NC2=CC=C(C=C2)S(=O)(=O)[N-]C3=NC=CC=N3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NNC(=S)NC2=CC=C(C=C2)S(=O)(=O)[N-]C3=NC=CC=N3

InChI

InChI=1S/C21H24N6O4S3/c1-21(2,3)15-5-9-18(10-6-15)34(30,31)27-25-20(32)24-16-7-11-17(12-8-16)33(28,29)26-19-22-13-4-14-23-19/h4-14,27H,1-3H3,(H3,22,23,24,25,26,32)/p-1