2-[4-(4-methoxyphenyl)butan-2-ylamino]-1-(4-methyl-3-methylsulfanyl-phenyl)ethanol

Systemtic Name: 2-[4-(4-methoxyphenyl)butan-2-ylamino]-1-(4-methyl-3-methylsulfanyl-phenyl)ethanol Openeye Name: 2-[[3-(4-methoxyphenyl)-1-methyl-propyl]amino]-1-(4-methyl-3-methylsulfanyl-phenyl)ethanol CAS Name: 2-[4-(4-methoxyphenyl)butan-2-ylamino]-1-[4-methyl-3-(methylthio)phenyl]ethanol IUPAC Name: 2-[4-(4-methoxyphenyl)butan-2-ylamino]-1-(4-methyl-3-methylsulfanylphenyl)ethanol Traditional Name: 2-[[3-(4-methoxyphenyl)-1-methyl-propyl]amino]-1-[4-methyl-3-(methylthio)phenyl]ethanol Formula: C21H29NO2S MolecularWeight: 359.52546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(CNC(C)CCC2=CC=C(C=C2)OC)O)SC

Isomeric SMILES

CC1=C(C=C(C=C1)C(CNC(C)CCC2=CC=C(C=C2)OC)O)SC

InChI

InChI=1S/C21H29NO2S/c1-15-5-10-18(13-21(15)25-4)20(23)14-22-16(2)6-7-17-8-11-19(24-3)12-9-17/h5,8-13,16,20,22-23H,6-7,14H2,1-4H3