sodium [5-[2-[(5-tert-butyl-2-methoxy-phenyl)carbonylamino]ethyl]-2-methoxy-phenyl]sulfonyl-(methylcarbamothioyl)azanide

Systemtic Name: sodium [5-[2-[(5-tert-butyl-2-methoxy-phenyl)carbonylamino]ethyl]-2-methoxy-phenyl]sulfonyl-(methylcarbamothioyl)azanide Openeye Name: sodium [5-[2-[(5-tert-butyl-2-methoxy-benzoyl)amino]ethyl]-2-methoxy-phenyl]sulfonyl-(methylcarbamothioyl)azanide CAS Name: sodium [5-[2-[[(5-tert-butyl-2-methoxyphenyl)-oxomethyl]amino]ethyl]-2-methoxyphenyl]sulfonyl-[methylamino(sulfanylidene)methyl]azanide IUPAC Name: sodium [5-[2-[(5-tert-butyl-2-methoxybenzoyl)amino]ethyl]-2-methoxyphenyl]sulfonyl-(methylcarbamothioyl)azanide Traditional Name: sodium [5-[2-[(5-tert-butyl-2-methoxy-benzoyl)amino]ethyl]-2-methoxy-phenyl]sulfonyl-(methylthiocarbamoyl)azanide Formula: C23H30N3NaO5S2 MolecularWeight: 515.62117

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)C(=O)NCCC2=CC(=C(C=C2)OC)S(=O)(=O)[N-]C(=S)NC.[Na+]

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)C(=O)NCCC2=CC(=C(C=C2)OC)S(=O)(=O)[N-]C(=S)NC.[Na+]

InChI

InChI=1S/C23H31N3O5S2.Na/c1-23(2,3)16-8-10-18(30-5)17(14-16)21(27)25-12-11-15-7-9-19(31-6)20(13-15)33(28,29)26-22(32)24-4;/h7-10,13-14H,11-12H2,1-6H3,(H3,24,25,26,27,32);/q;+1/p-1