ethyl 5-(2-benzamido-4-methyl-1,3-thiazol-5-yl)-1-(2-hydroxyethyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 5-(2-benzamido-4-methyl-1,3-thiazol-5-yl)-1-(2-hydroxyethyl)pyrazole-3-carboxylate Openeye Name: ethyl 5-(2-benzamido-4-methyl-thiazol-5-yl)-1-(2-hydroxyethyl)pyrazole-3-carboxylate CAS Name: 5-(2-benzamido-4-methyl-5-thiazolyl)-1-(2-hydroxyethyl)-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-benzamido-4-methyl-1,3-thiazol-5-yl)-1-(2-hydroxyethyl)pyrazole-3-carboxylate Traditional Name: 5-(2-benzamido-4-methyl-thiazol-5-yl)-1-(2-hydroxyethyl)pyrazole-3-carboxylic acid ethyl ester Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=C(N=C(S2)NC(=O)C3=CC=CC=C3)C)CCO

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=C(N=C(S2)NC(=O)C3=CC=CC=C3)C)CCO

InChI

InChI=1S/C19H20N4O4S/c1-3-27-18(26)14-11-15(23(22-14)9-10-24)16-12(2)20-19(28-16)21-17(25)13-7-5-4-6-8-13/h4-8,11,24H,3,9-10H2,1-2H3,(H,20,21,25)