1-[3-butyl-2-(1-sulfanylethyl)phenyl]ethanethiol

Systemtic Name: 1-[3-butyl-2-(1-sulfanylethyl)phenyl]ethanethiol Openeye Name: 1-[3-butyl-2-(1-sulfanylethyl)phenyl]ethanethiol CAS Name: 1-[3-butyl-2-(1-mercaptoethyl)phenyl]ethanethiol IUPAC Name: 1-[3-butyl-2-(1-sulfanylethyl)phenyl]ethanethiol Traditional Name: 1-[3-butyl-2-(1-mercaptoethyl)phenyl]ethanethiol Formula: C14H22S2 MolecularWeight: 254.45448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=CC=C1)C(C)S)C(C)S

Isomeric SMILES

CCCCC1=C(C(=CC=C1)C(C)S)C(C)S

InChI

InChI=1S/C14H22S2/c1-4-5-7-12-8-6-9-13(10(2)15)14(12)11(3)16/h6,8-11,15-16H,4-5,7H2,1-3H3