[(E,3Z)-3-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)non-1-enyl] (E)-3-phenylprop-2-enoate

Systemtic Name: [(E,3Z)-3-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)non-1-enyl] (E)-3-phenylprop-2-enoate Openeye Name: [(E,3Z)-3-(4-oxo-2-thioxo-thiazolidin-5-ylidene)non-1-enyl] (E)-3-phenylprop-2-enoate CAS Name: (E)-3-phenyl-2-propenoic acid [(E,3Z)-3-(4-oxo-2-sulfanylidene-5-thiazolidinylidene)non-1-enyl] ester IUPAC Name: [(E,3Z)-3-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)non-1-enyl] (E)-3-phenylprop-2-enoate Traditional Name: (E)-3-phenylacrylic acid [(E,3Z)-3-(4-keto-2-thioxo-thiazolidin-5-ylidene)non-1-enyl] ester Formula: C21H23NO3S2 MolecularWeight: 401.54222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=C1C(=O)NC(=S)S1)C=COC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCCCCC/C(=C/1\C(=O)NC(=S)S1)/C=C/OC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H23NO3S2/c1-2-3-4-8-11-17(19-20(24)22-21(26)27-19)14-15-25-18(23)13-12-16-9-6-5-7-10-16/h5-7,9-10,12-15H,2-4,8,11H2,1H3,(H,22,24,26)/b13-12+,15-14+,19-17-