3,5-ditert-butyl-N-[[3-[iminomethyl(thiophen-2-yl)amino]phenyl]methyl]-4-oxidanyl-benzamide

Systemtic Name: 3,5-ditert-butyl-N-[[3-[iminomethyl(thiophen-2-yl)amino]phenyl]methyl]-4-oxidanyl-benzamide Openeye Name: 3,5-ditert-butyl-4-hydroxy-N-[[3-[methanimidoyl(2-thienyl)amino]phenyl]methyl]benzamide CAS Name: 3,5-ditert-butyl-4-hydroxy-N-[[3-[methanimidoyl(thiophen-2-yl)amino]phenyl]methyl]benzamide IUPAC Name: 3,5-ditert-butyl-4-hydroxy-N-[[3-[methanimidoyl(thiophen-2-yl)amino]phenyl]methyl]benzamide Traditional Name: 3,5-ditert-butyl-N-[3-[formimidoyl(2-thienyl)amino]benzyl]-4-hydroxy-benzamide Formula: C27H33N3O2S MolecularWeight: 463.63482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)NCC2=CC(=CC=C2)N(C=N)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)NCC2=CC(=CC=C2)N(C=N)C3=CC=CS3

InChI

InChI=1S/C27H33N3O2S/c1-26(2,3)21-14-19(15-22(24(21)31)27(4,5)6)25(32)29-16-18-9-7-10-20(13-18)30(17-28)23-11-8-12-33-23/h7-15,17,28,31H,16H2,1-6H3,(H,29,32)