2-[2-[(3-methoxy-4-propan-2-yloxy-phenyl)methylamino]-2-oxidanylidene-ethyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[2-[(3-methoxy-4-propan-2-yloxy-phenyl)methylamino]-2-oxidanylidene-ethyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[2-[(4-isopropoxy-3-methoxy-phenyl)methylamino]-2-oxo-ethyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[2-[(3-methoxy-4-propan-2-yloxyphenyl)methylamino]-2-oxoethyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[2-[(3-methoxy-4-propan-2-yloxyphenyl)methylamino]-2-oxoethyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[2-[(4-isopropoxy-3-methoxy-benzyl)amino]-2-keto-ethyl]-4-methyl-thiazole-5-carboxylic acid Formula: C18H22N2O5S MolecularWeight: 378.44268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC(=O)NCC2=CC(=C(C=C2)OC(C)C)OC)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)CC(=O)NCC2=CC(=C(C=C2)OC(C)C)OC)C(=O)O

InChI

InChI=1S/C18H22N2O5S/c1-10(2)25-13-6-5-12(7-14(13)24-4)9-19-15(21)8-16-20-11(3)17(26-16)18(22)23/h5-7,10H,8-9H2,1-4H3,(H,19,21)(H,22,23)