ethyl 4-[[2-[(3-methyl-1-oxidanylidene-4H-isochromen-3-yl)carbonylamino]-1,3-thiazol-5-yl]methyl]benzoate

Systemtic Name: ethyl 4-[[2-[(3-methyl-1-oxidanylidene-4H-isochromen-3-yl)carbonylamino]-1,3-thiazol-5-yl]methyl]benzoate Openeye Name: ethyl 4-[[2-[(3-methyl-1-oxo-isochromane-3-carbonyl)amino]thiazol-5-yl]methyl]benzoate CAS Name: 4-[[2-[[(3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-yl)-oxomethyl]amino]-5-thiazolyl]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(3-methyl-1-oxo-4H-isochromene-3-carbonyl)amino]-1,3-thiazol-5-yl]methyl]benzoate Traditional Name: 4-[[2-[(1-keto-3-methyl-isochroman-3-carbonyl)amino]thiazol-5-yl]methyl]benzoic acid ethyl ester Formula: C24H22N2O5S MolecularWeight: 450.50688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3(CC4=CC=CC=C4C(=O)O3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3(CC4=CC=CC=C4C(=O)O3)C

InChI

InChI=1S/C24H22N2O5S/c1-3-30-20(27)16-10-8-15(9-11-16)12-18-14-25-23(32-18)26-22(29)24(2)13-17-6-4-5-7-19(17)21(28)31-24/h4-11,14H,3,12-13H2,1-2H3,(H,25,26,29)