(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 2-acetamido-1,3-thiazole-4-carboxylate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 2-acetamido-1,3-thiazole-4-carboxylate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 2-acetamidothiazole-4-carboxylate CAS Name: 2-acetamido-4-thiazolecarboxylic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 2-acetamido-1,3-thiazole-4-carboxylate Traditional Name: 2-acetamidothiazole-4-carboxylic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CSC(=N3)NC(=O)C)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CSC(=N3)NC(=O)C)C(C)C

InChI

InChI=1S/C20H20N2O5S/c1-10(2)14-7-15-13(6-18(24)27-17(15)5-11(14)3)8-26-19(25)16-9-28-20(22-16)21-12(4)23/h5-7,9-10H,8H2,1-4H3,(H,21,22,23)