4-methyl-2-[2-oxidanylidene-2-[2-(2,3,6-trimethylphenoxy)ethylamino]ethyl]-1,3-thiazole-5-carboxylate

Systemtic Name: 4-methyl-2-[2-oxidanylidene-2-[2-(2,3,6-trimethylphenoxy)ethylamino]ethyl]-1,3-thiazole-5-carboxylate Openeye Name: 4-methyl-2-[2-oxo-2-[2-(2,3,6-trimethylphenoxy)ethylamino]ethyl]thiazole-5-carboxylate CAS Name: 4-methyl-2-[2-oxo-2-[2-(2,3,6-trimethylphenoxy)ethylamino]ethyl]-5-thiazolecarboxylate IUPAC Name: 4-methyl-2-[2-oxo-2-[2-(2,3,6-trimethylphenoxy)ethylamino]ethyl]-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-keto-2-[2-(2,3,6-trimethylphenoxy)ethylamino]ethyl]-4-methyl-thiazole-5-carboxylate Formula: C18H21N2O4S- MolecularWeight: 361.43534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCCNC(=O)CC2=NC(=C(S2)C(=O)[O-])C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCCNC(=O)CC2=NC(=C(S2)C(=O)[O-])C)C

InChI

InChI=1S/C18H22N2O4S/c1-10-5-6-11(2)16(12(10)3)24-8-7-19-14(21)9-15-20-13(4)17(25-15)18(22)23/h5-6H,7-9H2,1-4H3,(H,19,21)(H,22,23)/p-1