N-[(5-tert-butyl-3-methyl-2-oxidanyl-phenyl)carbonylamino]-N'-(phenylsulfonyl)benzenecarboximidamide

Systemtic Name: N-[(5-tert-butyl-3-methyl-2-oxidanyl-phenyl)carbonylamino]-N'-(phenylsulfonyl)benzenecarboximidamide Openeye Name: N'-(benzenesulfonyl)-N-[(5-tert-butyl-2-hydroxy-3-methyl-benzoyl)amino]benzamidine CAS Name: N'-(benzenesulfonyl)-N-[[(5-tert-butyl-2-hydroxy-3-methylphenyl)-oxomethyl]amino]benzenecarboximidamide IUPAC Name: N'-(benzenesulfonyl)-N-[(5-tert-butyl-2-hydroxy-3-methylbenzoyl)amino]benzenecarboximidamide Traditional Name: N'-besyl-N-[(5-tert-butyl-2-hydroxy-3-methyl-benzoyl)amino]benzamidine Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(C)(C)C)C(=O)NNC(=NS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)O

Isomeric SMILES

CC1=C(C(=CC(=C1)C(C)(C)C)C(=O)NN/C(=N/S(=O)(=O)C2=CC=CC=C2)/C3=CC=CC=C3)O

InChI

InChI=1S/C25H27N3O4S/c1-17-15-19(25(2,3)4)16-21(22(17)29)24(30)27-26-23(18-11-7-5-8-12-18)28-33(31,32)20-13-9-6-10-14-20/h5-16,29H,1-4H3,(H,26,28)(H,27,30)