ethyl 5-(morpholin-4-ylmethyl)-1-(4-phenyl-1,3-thiazol-2-yl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-(morpholin-4-ylmethyl)-1-(4-phenyl-1,3-thiazol-2-yl)pyrazole-4-carboxylate Openeye Name: ethyl 5-(morpholinomethyl)-1-(4-phenylthiazol-2-yl)pyrazole-4-carboxylate CAS Name: 5-(4-morpholinylmethyl)-1-(4-phenyl-2-thiazolyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(morpholin-4-ylmethyl)-1-(4-phenyl-1,3-thiazol-2-yl)pyrazole-4-carboxylate Traditional Name: 5-(morpholinomethyl)-1-(4-phenylthiazol-2-yl)pyrazole-4-carboxylic acid ethyl ester Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC=CC=C3)CN4CCOCC4

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC=CC=C3)CN4CCOCC4

InChI

InChI=1S/C20H22N4O3S/c1-2-27-19(25)16-12-21-24(18(16)13-23-8-10-26-11-9-23)20-22-17(14-28-20)15-6-4-3-5-7-15/h3-7,12,14H,2,8-11,13H2,1H3