S-propyl 2-phenyl-2-pyridin-4-yl-propanethioate

Systemtic Name: S-propyl 2-phenyl-2-pyridin-4-yl-propanethioate Openeye Name: S-propyl 2-phenyl-2-(4-pyridyl)propanethioate CAS Name: 2-phenyl-2-pyridin-4-ylpropanethioic acid S-propyl ester IUPAC Name: S-propyl 2-phenyl-2-pyridin-4-ylpropanethioate Traditional Name: 2-phenyl-2-(4-pyridyl)propanethioic acid S-propyl ester Formula: C17H19NOS MolecularWeight: 285.40386

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(=O)C(C)(C1=CC=CC=C1)C2=CC=NC=C2

Isomeric SMILES

CCCSC(=O)C(C)(C1=CC=CC=C1)C2=CC=NC=C2

InChI

InChI=1S/C17H19NOS/c1-3-13-20-16(19)17(2,14-7-5-4-6-8-14)15-9-11-18-12-10-15/h4-12H,3,13H2,1-2H3