5-[4-(morpholin-4-ylmethyl)-2-phenyl-1,3-thiazol-5-yl]-1H-pyrazole-3-carboxylic acid

Systemtic Name: 5-[4-(morpholin-4-ylmethyl)-2-phenyl-1,3-thiazol-5-yl]-1H-pyrazole-3-carboxylic acid Openeye Name: 5-[4-(morpholinomethyl)-2-phenyl-thiazol-5-yl]-1H-pyrazole-3-carboxylic acid CAS Name: 5-[4-(4-morpholinylmethyl)-2-phenyl-5-thiazolyl]-1H-pyrazole-3-carboxylic acid IUPAC Name: 5-[4-(morpholin-4-ylmethyl)-2-phenyl-1,3-thiazol-5-yl]-1H-pyrazole-3-carboxylic acid Traditional Name: 5-[4-(morpholinomethyl)-2-phenyl-thiazol-5-yl]-1H-pyrazole-3-carboxylic acid Formula: C18H18N4O3S MolecularWeight: 370.42552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=C(SC(=N2)C3=CC=CC=C3)C4=CC(=NN4)C(=O)O

Isomeric SMILES

C1COCCN1CC2=C(SC(=N2)C3=CC=CC=C3)C4=CC(=NN4)C(=O)O

InChI

InChI=1S/C18H18N4O3S/c23-18(24)14-10-13(20-21-14)16-15(11-22-6-8-25-9-7-22)19-17(26-16)12-4-2-1-3-5-12/h1-5,10H,6-9,11H2,(H,20,21)(H,23,24)