5-(2-hydroxyphenyl)sulfanyl-2-methyl-pentanenitrile

Systemtic Name: 5-(2-hydroxyphenyl)sulfanyl-2-methyl-pentanenitrile Openeye Name: 5-(2-hydroxyphenyl)sulfanyl-2-methyl-pentanenitrile CAS Name: 5-[(2-hydroxyphenyl)thio]-2-methylpentanenitrile IUPAC Name: 5-(2-hydroxyphenyl)sulfanyl-2-methylpentanenitrile Traditional Name: 5-[(2-hydroxyphenyl)thio]-2-methyl-valeronitrile Formula: C12H15NOS MolecularWeight: 221.3186

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCSC1=CC=CC=C1O)C#N

Isomeric SMILES

CC(CCCSC1=CC=CC=C1O)C#N

InChI

InChI=1S/C12H15NOS/c1-10(9-13)5-4-8-15-12-7-3-2-6-11(12)14/h2-3,6-7,10,14H,4-5,8H2,1H3