4-[3-(2,4-ditert-butylpyrrolidin-1-yl)propylsulfanyl]phenol

Systemtic Name: 4-[3-(2,4-ditert-butylpyrrolidin-1-yl)propylsulfanyl]phenol Openeye Name: 4-[3-(2,4-ditert-butylpyrrolidin-1-yl)propylsulfanyl]phenol CAS Name: 4-[3-(2,4-ditert-butyl-1-pyrrolidinyl)propylthio]phenol IUPAC Name: 4-[3-(2,4-ditert-butylpyrrolidin-1-yl)propylsulfanyl]phenol Traditional Name: 4-[3-(2,4-ditert-butylpyrrolidino)propylthio]phenol Formula: C21H35NOS MolecularWeight: 349.5737

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC(N(C1)CCCSC2=CC=C(C=C2)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1CC(N(C1)CCCSC2=CC=C(C=C2)O)C(C)(C)C

InChI

InChI=1S/C21H35NOS/c1-20(2,3)16-14-19(21(4,5)6)22(15-16)12-7-13-24-18-10-8-17(23)9-11-18/h8-11,16,19,23H,7,12-15H2,1-6H3