propyl 2-[(5E)-4-oxidanylidene-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenyl-ethanoate

Systemtic Name: propyl 2-[(5E)-4-oxidanylidene-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenyl-ethanoate Openeye Name: propyl 2-[(5E)-4-oxo-5-(4-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]-2-phenyl-acetate CAS Name: 2-[(5E)-4-oxo-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-3-thiazolidinyl]-2-phenylacetic acid propyl ester IUPAC Name: propyl 2-[(5E)-4-oxo-5-(pyridin-4-ylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]-2-phenylacetate Traditional Name: 2-[(5E)-4-keto-5-(4-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]-2-phenyl-acetic acid propyl ester Formula: C20H18N2O3S2 MolecularWeight: 398.49852

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C1=CC=CC=C1)N2C(=O)C(=CC3=CC=NC=C3)SC2=S

Isomeric SMILES

CCCOC(=O)C(C1=CC=CC=C1)N2C(=O)/C(=C\C3=CC=NC=C3)/SC2=S

InChI

InChI=1S/C20H18N2O3S2/c1-2-12-25-19(24)17(15-6-4-3-5-7-15)22-18(23)16(27-20(22)26)13-14-8-10-21-11-9-14/h3-11,13,17H,2,12H2,1H3/b16-13+