(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 2-[(phenylmethyl)amino]-1,3-thiazole-4-carboxylate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 2-[(phenylmethyl)amino]-1,3-thiazole-4-carboxylate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 2-(benzylamino)thiazole-4-carboxylate CAS Name: 2-[(phenylmethyl)amino]-4-thiazolecarboxylic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 2-(benzylamino)-1,3-thiazole-4-carboxylate Traditional Name: 2-(benzylamino)thiazole-4-carboxylic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C22H18N2O5S MolecularWeight: 422.45372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CSC(=N3)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CSC(=N3)NCC4=CC=CC=C4

InChI

InChI=1S/C22H18N2O5S/c1-27-16-7-8-17-15(9-20(25)29-19(17)10-16)12-28-21(26)18-13-30-22(24-18)23-11-14-5-3-2-4-6-14/h2-10,13H,11-12H2,1H3,(H,23,24)