N-(4-tert-butylphenyl)sulfonyl-N-(2-oxidanylidenebenzo[g][1,3]benzoxathiol-5-yl)pyridine-3-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)sulfonyl-N-(2-oxidanylidenebenzo[g][1,3]benzoxathiol-5-yl)pyridine-3-carboxamide Openeye Name: N-(4-tert-butylphenyl)sulfonyl-N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)pyridine-3-carboxamide CAS Name: N-(4-tert-butylphenyl)sulfonyl-N-(2-oxo-5-benzo[g][1,3]benzoxathiolyl)-3-pyridinecarboxamide IUPAC Name: N-(4-tert-butylphenyl)sulfonyl-N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)pyridine-3-carboxamide Traditional Name: N-(4-tert-butylphenyl)sulfonyl-N-(2-ketobenzo[g][1,3]benzoxathiol-5-yl)nicotinamide Formula: C27H22N2O5S2 MolecularWeight: 518.60398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C4=CC=CC=C42)OC(=O)S3)C(=O)C5=CN=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C4=CC=CC=C42)OC(=O)S3)C(=O)C5=CN=CC=C5

InChI

InChI=1S/C27H22N2O5S2/c1-27(2,3)18-10-12-19(13-11-18)36(32,33)29(25(30)17-7-6-14-28-16-17)22-15-23-24(34-26(31)35-23)21-9-5-4-8-20(21)22/h4-16H,1-3H3