N'-[3-[[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylamino]methyl]phenyl]thiophene-2-carboximidamide

Systemtic Name: N'-[3-[[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylamino]methyl]phenyl]thiophene-2-carboximidamide Openeye Name: N'-[3-[[(3,5-ditert-butyl-4-hydroxy-phenyl)methylamino]methyl]phenyl]thiophene-2-carboxamidine CAS Name: N'-[3-[[(3,5-ditert-butyl-4-hydroxyphenyl)methylamino]methyl]phenyl]-2-thiophenecarboximidamide IUPAC Name: N'-[3-[[(3,5-ditert-butyl-4-hydroxyphenyl)methylamino]methyl]phenyl]thiophene-2-carboximidamide Traditional Name: N'-[3-[[(3,5-ditert-butyl-4-hydroxy-benzyl)amino]methyl]phenyl]thiophene-2-carboxamidine Formula: C27H35N3OS MolecularWeight: 449.6513

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CNCC2=CC(=CC=C2)N=C(C3=CC=CS3)N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CNCC2=CC(=CC=C2)N=C(C3=CC=CS3)N

InChI

InChI=1S/C27H35N3OS/c1-26(2,3)21-14-19(15-22(24(21)31)27(4,5)6)17-29-16-18-9-7-10-20(13-18)30-25(28)23-11-8-12-32-23/h7-15,29,31H,16-17H2,1-6H3,(H2,28,30)