2-azanyl-5-[2-(3-chlorophenyl)ethyl]-1,3-thiazole-4-carboxylic acid

Systemtic Name: 2-azanyl-5-[2-(3-chlorophenyl)ethyl]-1,3-thiazole-4-carboxylic acid Openeye Name: 2-amino-5-[2-(3-chlorophenyl)ethyl]thiazole-4-carboxylic acid CAS Name: 2-amino-5-[2-(3-chlorophenyl)ethyl]-4-thiazolecarboxylic acid IUPAC Name: 2-amino-5-[2-(3-chlorophenyl)ethyl]-1,3-thiazole-4-carboxylic acid Traditional Name: 2-amino-5-[2-(3-chlorophenyl)ethyl]thiazole-4-carboxylic acid Formula: C12H11ClN2O2S MolecularWeight: 282.74594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CCC2=C(N=C(S2)N)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CCC2=C(N=C(S2)N)C(=O)O

InChI

InChI=1S/C12H11ClN2O2S/c13-8-3-1-2-7(6-8)4-5-9-10(11(16)17)15-12(14)18-9/h1-3,6H,4-5H2,(H2,14,15)(H,16,17)