methyl 4-[[4-[2-cyano-3-oxidanylidene-3-(1,3-thiazol-2-ylamino)prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[4-[2-cyano-3-oxidanylidene-3-(1,3-thiazol-2-ylamino)prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoate Openeye Name: methyl 4-[[4-[2-cyano-3-oxo-3-(thiazol-2-ylamino)prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoate CAS Name: 4-[[4-[2-cyano-3-oxo-3-(2-thiazolylamino)prop-1-enyl]-2-methoxyphenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[2-cyano-3-oxo-3-(1,3-thiazol-2-ylamino)prop-1-enyl]-2-methoxyphenoxy]methyl]benzoate Traditional Name: 4-[[4-[2-cyano-3-keto-3-(thiazol-2-ylamino)prop-1-enyl]-2-methoxy-phenoxy]methyl]benzoic acid methyl ester Formula: C23H19N3O5S MolecularWeight: 449.47906

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=NC=CS2)OCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=NC=CS2)OCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H19N3O5S/c1-29-20-12-16(11-18(13-24)21(27)26-23-25-9-10-32-23)5-8-19(20)31-14-15-3-6-17(7-4-15)22(28)30-2/h3-12H,14H2,1-2H3,(H,25,26,27)