3,3-dimethyl-1-(4-methylphenyl)sulfanyl-2-pyridin-3-yl-butan-2-ol

Systemtic Name: 3,3-dimethyl-1-(4-methylphenyl)sulfanyl-2-pyridin-3-yl-butan-2-ol Openeye Name: 3,3-dimethyl-1-(p-tolylsulfanyl)-2-(3-pyridyl)butan-2-ol CAS Name: 3,3-dimethyl-1-[(4-methylphenyl)thio]-2-(3-pyridinyl)-2-butanol IUPAC Name: 3,3-dimethyl-1-(4-methylphenyl)sulfanyl-2-pyridin-3-ylbutan-2-ol Traditional Name: 3,3-dimethyl-1-(p-tolylthio)-2-(3-pyridyl)butan-2-ol Formula: C18H23NOS MolecularWeight: 301.44632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(C2=CN=CC=C2)(C(C)(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)SCC(C2=CN=CC=C2)(C(C)(C)C)O

InChI

InChI=1S/C18H23NOS/c1-14-7-9-16(10-8-14)21-13-18(20,17(2,3)4)15-6-5-11-19-12-15/h5-12,20H,13H2,1-4H3