(2-bromanyl-4-cyano-6-ethoxy-phenyl) 2-thiophen-3-yl-1,3-thiazole-4-carboxylate

Systemtic Name: (2-bromanyl-4-cyano-6-ethoxy-phenyl) 2-thiophen-3-yl-1,3-thiazole-4-carboxylate Openeye Name: (2-bromo-4-cyano-6-ethoxy-phenyl) 2-(3-thienyl)thiazole-4-carboxylate CAS Name: 2-(3-thiophenyl)-4-thiazolecarboxylic acid (2-bromo-4-cyano-6-ethoxyphenyl) ester IUPAC Name: (2-bromo-4-cyano-6-ethoxyphenyl) 2-thiophen-3-yl-1,3-thiazole-4-carboxylate Traditional Name: 2-(3-thienyl)thiazole-4-carboxylic acid (2-bromo-4-cyano-6-ethoxy-phenyl) ester Formula: C17H11BrN2O3S2 MolecularWeight: 435.31484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)C2=CSC(=N2)C3=CSC=C3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C#N)Br)OC(=O)C2=CSC(=N2)C3=CSC=C3

InChI

InChI=1S/C17H11BrN2O3S2/c1-2-22-14-6-10(7-19)5-12(18)15(14)23-17(21)13-9-25-16(20-13)11-3-4-24-8-11/h3-6,8-9H,2H2,1H3