3,3-dimethyl-1-naphthalen-2-ylsulfanyl-2-pyridin-3-yl-butan-2-ol

Systemtic Name: 3,3-dimethyl-1-naphthalen-2-ylsulfanyl-2-pyridin-3-yl-butan-2-ol Openeye Name: 3,3-dimethyl-1-(2-naphthylsulfanyl)-2-(3-pyridyl)butan-2-ol CAS Name: 3,3-dimethyl-1-(2-naphthalenylthio)-2-(3-pyridinyl)-2-butanol IUPAC Name: 3,3-dimethyl-1-naphthalen-2-ylsulfanyl-2-pyridin-3-ylbutan-2-ol Traditional Name: 3,3-dimethyl-1-(2-naphthylthio)-2-(3-pyridyl)butan-2-ol Formula: C21H23NOS MolecularWeight: 337.47842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CSC1=CC2=CC=CC=C2C=C1)(C3=CN=CC=C3)O

Isomeric SMILES

CC(C)(C)C(CSC1=CC2=CC=CC=C2C=C1)(C3=CN=CC=C3)O

InChI

InChI=1S/C21H23NOS/c1-20(2,3)21(23,18-9-6-12-22-14-18)15-24-19-11-10-16-7-4-5-8-17(16)13-19/h4-14,23H,15H2,1-3H3