3-(4-butylphenyl)-2-cyano-prop-2-enethioamide

Systemtic Name: 3-(4-butylphenyl)-2-cyano-prop-2-enethioamide Openeye Name: 3-(4-butylphenyl)-2-cyano-prop-2-enethioamide CAS Name: 3-(4-butylphenyl)-2-cyano-2-propenethioamide IUPAC Name: 3-(4-butylphenyl)-2-cyanoprop-2-enethioamide Traditional Name: 3-(4-butylphenyl)-2-cyano-thioacrylamide Formula: C14H16N2S MolecularWeight: 244.35524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C=C(C#N)C(=S)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)C=C(C#N)C(=S)N

InChI

InChI=1S/C14H16N2S/c1-2-3-4-11-5-7-12(8-6-11)9-13(10-15)14(16)17/h5-9H,2-4H2,1H3,(H2,16,17)