ethyl 4-methyl-2-[4-oxidanyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2-pyridin-3-yl-2H-pyrrol-1-yl]-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-[4-oxidanyl-5-oxidanylidene-3-[(E)-3-phenylprop-2-enoyl]-2-pyridin-3-yl-2H-pyrrol-1-yl]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[4-hydroxy-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2-(3-pyridyl)-2H-pyrrol-1-yl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[4-hydroxy-5-oxo-3-[(E)-1-oxo-3-phenylprop-2-enyl]-2-(3-pyridinyl)-2H-pyrrol-1-yl]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-hydroxy-5-oxo-3-[(E)-3-phenylprop-2-enoyl]-2-pyridin-3-yl-2H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[3-hydroxy-2-keto-4-[(E)-3-phenylacryloyl]-5-(3-pyridyl)-3-pyrrolin-1-yl]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C25H21N3O5S MolecularWeight: 475.51634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C2=O)O)C(=O)C=CC3=CC=CC=C3)C4=CN=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)N2C(C(=C(C2=O)O)C(=O)/C=C/C3=CC=CC=C3)C4=CN=CC=C4)C

InChI

InChI=1S/C25H21N3O5S/c1-3-33-24(32)22-15(2)27-25(34-22)28-20(17-10-7-13-26-14-17)19(21(30)23(28)31)18(29)12-11-16-8-5-4-6-9-16/h4-14,20,30H,3H2,1-2H3/b12-11+