4-(3-cyanophenyl)-2-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-(3-cyanophenyl)-2-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 4-(3-cyanophenyl)-2-methyl-thiazole-5-carboxylic acid CAS Name: 4-(3-cyanophenyl)-2-methyl-5-thiazolecarboxylic acid IUPAC Name: 4-(3-cyanophenyl)-2-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 4-(3-cyanophenyl)-2-methyl-thiazole-5-carboxylic acid Formula: C12H8N2O2S MolecularWeight: 244.26912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(S1)C(=O)O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=NC(=C(S1)C(=O)O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C12H8N2O2S/c1-7-14-10(11(17-7)12(15)16)9-4-2-3-8(5-9)6-13/h2-5H,1H3,(H,15,16)