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

Systemtic Name: 4-methyl-2-(3-phenylpropylamino)-1,3-thiazole-5-carboxylic acid Openeye Name: 4-methyl-2-(3-phenylpropylamino)thiazole-5-carboxylic acid CAS Name: 4-methyl-2-(3-phenylpropylamino)-5-thiazolecarboxylic acid IUPAC Name: 4-methyl-2-(3-phenylpropylamino)-1,3-thiazole-5-carboxylic acid Traditional Name: 4-methyl-2-(3-phenylpropylamino)thiazole-5-carboxylic acid Formula: C14H16N2O2S MolecularWeight: 276.35404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NCCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)NCCCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H16N2O2S/c1-10-12(13(17)18)19-14(16-10)15-9-5-8-11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3,(H,15,16)(H,17,18)