[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 4-oxidanylidene-4-[(4-phenyl-1,3-thiazol-2-yl)amino]butanoate

Systemtic Name: [2-(3-methoxyphenyl)-2-oxidanylidene-ethyl] 4-oxidanylidene-4-[(4-phenyl-1,3-thiazol-2-yl)amino]butanoate Openeye Name: [2-(3-methoxyphenyl)-2-oxo-ethyl] 4-oxo-4-[(4-phenylthiazol-2-yl)amino]butanoate CAS Name: 4-oxo-4-[(4-phenyl-2-thiazolyl)amino]butanoic acid [2-(3-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methoxyphenyl)-2-oxoethyl] 4-oxo-4-[(4-phenyl-1,3-thiazol-2-yl)amino]butanoate Traditional Name: 4-keto-4-[(4-phenylthiazol-2-yl)amino]butyric acid [2-keto-2-(3-methoxyphenyl)ethyl] ester Formula: C22H20N2O5S MolecularWeight: 424.4696

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)COC(=O)CCC(=O)NC2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)COC(=O)CCC(=O)NC2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C22H20N2O5S/c1-28-17-9-5-8-16(12-17)19(25)13-29-21(27)11-10-20(26)24-22-23-18(14-30-22)15-6-3-2-4-7-15/h2-9,12,14H,10-11,13H2,1H3,(H,23,24,26)