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

Systemtic Name: 2-[2-[2-(3,5-dimethylphenoxy)ethylamino]-2-oxidanylidene-ethyl]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: 2-[2-[2-(3,5-dimethylphenoxy)ethylamino]-2-oxo-ethyl]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[2-[2-(3,5-dimethylphenoxy)ethylamino]-2-oxoethyl]-4-methyl-5-thiazolecarboxylate IUPAC Name: 2-[2-[2-(3,5-dimethylphenoxy)ethylamino]-2-oxoethyl]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-[2-(3,5-dimethylphenoxy)ethylamino]-2-keto-ethyl]-4-methyl-thiazole-5-carboxylate Formula: C17H19N2O4S- MolecularWeight: 347.40876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O4S/c1-10-6-11(2)8-13(7-10)23-5-4-18-14(20)9-15-19-12(3)16(24-15)17(21)22/h6-8H,4-5,9H2,1-3H3,(H,18,20)(H,21,22)/p-1