3-azanyl-1-(2-tert-butyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-1-yl)-4-phenylsulfanyl-butan-2-ol

Systemtic Name: 3-azanyl-1-(2-tert-butyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-1-yl)-4-phenylsulfanyl-butan-2-ol Openeye Name: 3-amino-1-(2-tert-butyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-1-yl)-4-phenylsulfanyl-butan-2-ol CAS Name: 3-amino-1-(2-tert-butyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-1-yl)-4-(phenylthio)-2-butanol IUPAC Name: 3-amino-1-(2-tert-butyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-1-yl)-4-phenylsulfanylbutan-2-ol Traditional Name: 3-amino-1-(2-tert-butyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-1-yl)-4-(phenylthio)butan-2-ol Formula: C23H38N2OS MolecularWeight: 390.62562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1CCC2CCCCC2C1CC(C(CSC3=CC=CC=C3)N)O

Isomeric SMILES

CC(C)(C)N1CCC2CCCCC2C1CC(C(CSC3=CC=CC=C3)N)O

InChI

InChI=1S/C23H38N2OS/c1-23(2,3)25-14-13-17-9-7-8-12-19(17)21(25)15-22(26)20(24)16-27-18-10-5-4-6-11-18/h4-6,10-11,17,19-22,26H,7-9,12-16,24H2,1-3H3