methyl 4-[4-oxidanyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-1-(1,3-thiazol-2-yl)-2H-pyrrol-2-yl]benzoate

Systemtic Name: methyl 4-[4-oxidanyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-1-(1,3-thiazol-2-yl)-2H-pyrrol-2-yl]benzoate Openeye Name: methyl 4-[4-hydroxy-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-1-thiazol-2-yl-2H-pyrrol-2-yl]benzoate CAS Name: 4-[4-hydroxy-5-oxo-3-[(E)-1-oxo-3-phenylprop-2-enyl]-1-(2-thiazolyl)-2H-pyrrol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-hydroxy-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-1-(1,3-thiazol-2-yl)-2H-pyrrol-2-yl]benzoate Traditional Name: 4-[4-hydroxy-5-keto-3-[(E)-3-phenylacryloyl]-1-thiazol-2-yl-3-pyrrolin-2-yl]benzoic acid methyl ester Formula: C24H18N2O5S MolecularWeight: 446.47512

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NC=CS3)O)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2C(=C(C(=O)N2C3=NC=CS3)O)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C24H18N2O5S/c1-31-23(30)17-10-8-16(9-11-17)20-19(18(27)12-7-15-5-3-2-4-6-15)21(28)22(29)26(20)24-25-13-14-32-24/h2-14,20,28H,1H3/b12-7+