N-(2-butylphenyl)-1-cyano-N-methyl-methanethioamide

Systemtic Name: N-(2-butylphenyl)-1-cyano-N-methyl-methanethioamide Openeye Name: N-(2-butylphenyl)-1-cyano-N-methyl-thioformamide CAS Name: N-(2-butylphenyl)-1-cyano-N-methylmethanethioamide IUPAC Name: N-(2-butylphenyl)-1-cyano-N-methylmethanethioamide Traditional Name: N-(2-butylphenyl)-1-cyano-N-methyl-thioformamide Formula: C13H16N2S MolecularWeight: 232.34454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC=C1N(C)C(=S)C#N

Isomeric SMILES

CCCCC1=CC=CC=C1N(C)C(=S)C#N

InChI

InChI=1S/C13H16N2S/c1-3-4-7-11-8-5-6-9-12(11)15(2)13(16)10-14/h5-6,8-9H,3-4,7H2,1-2H3