4-ethyl-2-(3-pentoxyphenyl)-1,3-thiazole-5-carboxylate

Systemtic Name: 4-ethyl-2-(3-pentoxyphenyl)-1,3-thiazole-5-carboxylate Openeye Name: 4-ethyl-2-(3-pentoxyphenyl)thiazole-5-carboxylate CAS Name: 4-ethyl-2-(3-pentoxyphenyl)-5-thiazolecarboxylate IUPAC Name: 4-ethyl-2-(3-pentoxyphenyl)-1,3-thiazole-5-carboxylate Traditional Name: 2-(3-amoxyphenyl)-4-ethyl-thiazole-5-carboxylate Formula: C17H20NO3S- MolecularWeight: 318.4106

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)C2=NC(=C(S2)C(=O)[O-])CC

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)C2=NC(=C(S2)C(=O)[O-])CC

InChI

InChI=1S/C17H21NO3S/c1-3-5-6-10-21-13-9-7-8-12(11-13)16-18-14(4-2)15(22-16)17(19)20/h7-9,11H,3-6,10H2,1-2H3,(H,19,20)/p-1