7-(4-methylphenyl)-7-sulfanylidene-heptanenitrile

Systemtic Name: 7-(4-methylphenyl)-7-sulfanylidene-heptanenitrile Openeye Name: 7-(p-tolyl)-7-thioxo-heptanenitrile CAS Name: 7-(4-methylphenyl)-7-sulfanylideneheptanenitrile IUPAC Name: 7-(4-methylphenyl)-7-sulfanylideneheptanenitrile Traditional Name: 7-(p-tolyl)-7-thioxo-enanthonitrile Formula: C14H17NS MolecularWeight: 231.35648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=S)CCCCCC#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=S)CCCCCC#N

InChI

InChI=1S/C14H17NS/c1-12-7-9-13(10-8-12)14(16)6-4-2-3-5-11-15/h7-10H,2-6H2,1H3