ethyl 2-[4-[[5-azanylidene-3-oxidanylidene-4-(1,3-thiazol-2-yl)thiolan-2-ylidene]methyl]-2-ethoxy-phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[[5-azanylidene-3-oxidanylidene-4-(1,3-thiazol-2-yl)thiolan-2-ylidene]methyl]-2-ethoxy-phenoxy]ethanoate Openeye Name: ethyl 2-[2-ethoxy-4-[(5-imino-3-oxo-4-thiazol-2-yl-tetrahydrothiophen-2-ylidene)methyl]phenoxy]acetate CAS Name: 2-[2-ethoxy-4-[[5-imino-3-oxo-4-(2-thiazolyl)-2-thiolanylidene]methyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-ethoxy-4-[[5-imino-3-oxo-4-(1,3-thiazol-2-yl)thiolan-2-ylidene]methyl]phenoxy]acetate Traditional Name: 2-[2-ethoxy-4-[(5-imino-3-keto-4-thiazol-2-yl-tetrahydrothiophen-2-ylidene)methyl]phenoxy]acetic acid ethyl ester Formula: C20H20N2O5S2 MolecularWeight: 432.5132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C2C(=O)C(C(=N)S2)C3=NC=CS3)OCC(=O)OCC

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C2C(=O)C(C(=N)S2)C3=NC=CS3)OCC(=O)OCC

InChI

InChI=1S/C20H20N2O5S2/c1-3-25-14-9-12(5-6-13(14)27-11-16(23)26-4-2)10-15-18(24)17(19(21)29-15)20-22-7-8-28-20/h5-10,17,21H,3-4,11H2,1-2H3