5-(4-azanyl-2-methyl-phenyl)sulfanylpentanenitrile

Systemtic Name: 5-(4-azanyl-2-methyl-phenyl)sulfanylpentanenitrile Openeye Name: 5-(4-amino-2-methyl-phenyl)sulfanylpentanenitrile CAS Name: 5-[(4-amino-2-methylphenyl)thio]pentanenitrile IUPAC Name: 5-(4-amino-2-methylphenyl)sulfanylpentanenitrile Traditional Name: 5-[(4-amino-2-methyl-phenyl)thio]valeronitrile Formula: C12H16N2S MolecularWeight: 220.33384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)SCCCCC#N

Isomeric SMILES

CC1=C(C=CC(=C1)N)SCCCCC#N

InChI

InChI=1S/C12H16N2S/c1-10-9-11(14)5-6-12(10)15-8-4-2-3-7-13/h5-6,9H,2-4,8,14H2,1H3