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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NNC(=C1)C2=C(N=C(S2)C3=CC=CC=C3)CN4CCOCC4

Isomeric SMILES

CCOC(=O)C1=NNC(=C1)C2=C(N=C(S2)C3=CC=CC=C3)CN4CCOCC4

InChI

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