2-[5-bromanyl-2-(2-diethylaminoethyloxy)phenyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-[5-bromanyl-2-(2-diethylaminoethyloxy)phenyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-[5-bromo-2-(2-diethylaminoethyloxy)phenyl]thiazole-4-carboxylic acid CAS Name: 2-[5-bromo-2-(2-diethylaminoethyloxy)phenyl]-4-thiazolecarboxylic acid IUPAC Name: 2-[5-bromo-2-(2-diethylaminoethyloxy)phenyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-[5-bromo-2-(2-diethylaminoethyloxy)phenyl]thiazole-4-carboxylic acid Formula: C16H19BrN2O3S MolecularWeight: 399.30266

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=C(C=C(C=C1)Br)C2=NC(=CS2)C(=O)O

Isomeric SMILES

CCN(CC)CCOC1=C(C=C(C=C1)Br)C2=NC(=CS2)C(=O)O

InChI

InChI=1S/C16H19BrN2O3S/c1-3-19(4-2)7-8-22-14-6-5-11(17)9-12(14)15-18-13(10-23-15)16(20)21/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,20,21)