2-phenyl-5-(propan-2-ylsulfanylmethyl)cyclohexa-1,3-diene-1-carbonitrile

Systemtic Name: 2-phenyl-5-(propan-2-ylsulfanylmethyl)cyclohexa-1,3-diene-1-carbonitrile Openeye Name: 5-(isopropylsulfanylmethyl)-2-phenyl-cyclohexa-1,3-diene-1-carbonitrile CAS Name: 2-phenyl-5-[(propan-2-ylthio)methyl]-1-cyclohexa-1,3-dienecarbonitrile IUPAC Name: 2-phenyl-5-(propan-2-ylsulfanylmethyl)cyclohexa-1,3-diene-1-carbonitrile Traditional Name: 5-[(isopropylthio)methyl]-2-phenyl-cyclohexa-1,3-diene-1-carbonitrile Formula: C17H19NS MolecularWeight: 269.40446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC1CC(=C(C=C1)C2=CC=CC=C2)C#N

Isomeric SMILES

CC(C)SCC1CC(=C(C=C1)C2=CC=CC=C2)C#N

InChI

InChI=1S/C17H19NS/c1-13(2)19-12-14-8-9-17(16(10-14)11-18)15-6-4-3-5-7-15/h3-9,13-14H,10,12H2,1-2H3