[5-(3-azanyl-2-cyano-3-sulfanylidene-prop-1-enyl)-2,4-dimethyl-phenyl]methyl ethanoate

Systemtic Name: [5-(3-azanyl-2-cyano-3-sulfanylidene-prop-1-enyl)-2,4-dimethyl-phenyl]methyl ethanoate Openeye Name: [5-(3-amino-2-cyano-3-thioxo-prop-1-enyl)-2,4-dimethyl-phenyl]methyl acetate CAS Name: acetic acid [5-(3-amino-2-cyano-3-sulfanylideneprop-1-enyl)-2,4-dimethylphenyl]methyl ester IUPAC Name: [5-(3-amino-2-cyano-3-sulfanylideneprop-1-enyl)-2,4-dimethylphenyl]methyl acetate Traditional Name: acetic acid [5-(3-amino-2-cyano-3-thioxo-prop-1-enyl)-2,4-dimethyl-benzyl] ester Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C=C(C#N)C(=S)N)COC(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C=C(C#N)C(=S)N)COC(=O)C)C

InChI

InChI=1S/C15H16N2O2S/c1-9-4-10(2)14(8-19-11(3)18)6-12(9)5-13(7-16)15(17)20/h4-6H,8H2,1-3H3,(H2,17,20)