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

Systemtic Name: 4-methyl-2-[(phenylmethyl)amino]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-(benzylamino)-4-methyl-thiazole-5-carboxylic acid CAS Name: 4-methyl-2-[(phenylmethyl)amino]-5-thiazolecarboxylic acid IUPAC Name: 2-(benzylamino)-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-(benzylamino)-4-methyl-thiazole-5-carboxylic acid Formula: C12H12N2O2S MolecularWeight: 248.30088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)NCC2=CC=CC=C2)C(=O)O

InChI

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