4-[(4-tert-butylphenyl)sulfonylamino]-2-(4-methylphenyl)sulfanyl-naphthalen-1-olate

Systemtic Name: 4-[(4-tert-butylphenyl)sulfonylamino]-2-(4-methylphenyl)sulfanyl-naphthalen-1-olate Openeye Name: 4-[(4-tert-butylphenyl)sulfonylamino]-2-(p-tolylsulfanyl)naphthalen-1-olate CAS Name: 4-[(4-tert-butylphenyl)sulfonylamino]-2-[(4-methylphenyl)thio]-1-naphthalenolate IUPAC Name: 4-[(4-tert-butylphenyl)sulfonylamino]-2-(4-methylphenyl)sulfanylnaphthalen-1-olate Traditional Name: 4-[(4-tert-butylphenyl)sulfonylamino]-2-(p-tolylthio)naphthalen-1-olate Formula: C27H26NO3S2- MolecularWeight: 476.63024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC=C(C=C4)C(C)(C)C)[O-]

InChI

InChI=1S/C27H27NO3S2/c1-18-9-13-20(14-10-18)32-25-17-24(22-7-5-6-8-23(22)26(25)29)28-33(30,31)21-15-11-19(12-16-21)27(2,3)4/h5-17,28-29H,1-4H3/p-1