methyl 2-[(1-oxidanylidene-3-phenyl-3,4-dihydroisochromen-6-yl)carbonylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[(1-oxidanylidene-3-phenyl-3,4-dihydroisochromen-6-yl)carbonylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[(1-oxo-3-phenyl-isochromane-6-carbonyl)amino]thiazole-5-carboxylate CAS Name: 2-[[oxo-(1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-yl)methyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[(1-oxo-3-phenyl-3,4-dihydroisochromene-6-carbonyl)amino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[(1-keto-3-phenyl-isochroman-6-carbonyl)amino]thiazole-5-carboxylic acid methyl ester Formula: C21H16N2O5S MolecularWeight: 408.42714

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O5S/c1-27-20(26)17-11-22-21(29-17)23-18(24)13-7-8-15-14(9-13)10-16(28-19(15)25)12-5-3-2-4-6-12/h2-9,11,16H,10H2,1H3,(H,22,23,24)