4-(2-methylphenyl)sulfanylpent-4-enenitrile

Systemtic Name: 4-(2-methylphenyl)sulfanylpent-4-enenitrile Openeye Name: 4-(o-tolylsulfanyl)pent-4-enenitrile CAS Name: 4-[(2-methylphenyl)thio]-4-pentenenitrile IUPAC Name: 4-(2-methylphenyl)sulfanylpent-4-enenitrile Traditional Name: 4-(o-tolylthio)pent-4-enenitrile Formula: C12H13NS MolecularWeight: 203.30332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SC(=C)CCC#N

Isomeric SMILES

CC1=CC=CC=C1SC(=C)CCC#N

InChI

InChI=1S/C12H13NS/c1-10-6-3-4-8-12(10)14-11(2)7-5-9-13/h3-4,6,8H,2,5,7H2,1H3