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

Systemtic Name: 2-azanylidene-4-methyl-3-(phenylmethyl)-1,3-thiazole-5-carboxylic acid Openeye Name: 3-benzyl-2-imino-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-imino-4-methyl-3-(phenylmethyl)-5-thiazolecarboxylic acid IUPAC Name: 3-benzyl-2-imino-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 3-benzyl-2-imino-4-methyl-4-thiazoline-5-carboxylic acid Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N)N1CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=C(SC(=N)N1CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C12H12N2O2S/c1-8-10(11(15)16)17-12(13)14(8)7-9-5-3-2-4-6-9/h2-6,13H,7H2,1H3,(H,15,16)