4-[3-(aminomethyl)-4-azanyl-phenyl]sulfanyl-2,6-ditert-butyl-phenol

Systemtic Name: 4-[3-(aminomethyl)-4-azanyl-phenyl]sulfanyl-2,6-ditert-butyl-phenol Openeye Name: 4-[4-amino-3-(aminomethyl)phenyl]sulfanyl-2,6-ditert-butyl-phenol CAS Name: 4-[[4-amino-3-(aminomethyl)phenyl]thio]-2,6-ditert-butylphenol IUPAC Name: 4-[4-amino-3-(aminomethyl)phenyl]sulfanyl-2,6-ditert-butylphenol Traditional Name: 4-[[4-amino-3-(aminomethyl)phenyl]thio]-2,6-ditert-butyl-phenol Formula: C21H30N2OS MolecularWeight: 358.5407

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC2=CC(=C(C=C2)N)CN

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC2=CC(=C(C=C2)N)CN

InChI

InChI=1S/C21H30N2OS/c1-20(2,3)16-10-15(11-17(19(16)24)21(4,5)6)25-14-7-8-18(23)13(9-14)12-22/h7-11,24H,12,22-23H2,1-6H3