2-[(3-bromophenyl)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[(3-bromophenyl)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[(3-bromophenyl)methyl]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[(3-bromophenyl)methyl]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[(3-bromophenyl)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(3-bromobenzyl)-4-methyl-thiazole-5-carboxylic acid Formula: C12H10BrNO2S MolecularWeight: 312.1823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC2=CC(=CC=C2)Br)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)CC2=CC(=CC=C2)Br)C(=O)O

InChI

InChI=1S/C12H10BrNO2S/c1-7-11(12(15)16)17-10(14-7)6-8-3-2-4-9(13)5-8/h2-5H,6H2,1H3,(H,15,16)