(2-acetamido-1,3-thiazol-4-yl)methyl 1,3-diphenylpyrazole-4-carboxylate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 1,3-diphenylpyrazole-4-carboxylate Openeye Name: (2-acetamidothiazol-4-yl)methyl 1,3-diphenylpyrazole-4-carboxylate CAS Name: 1,3-diphenyl-4-pyrazolecarboxylic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 1,3-diphenylpyrazole-4-carboxylate Traditional Name: 1,3-diphenylpyrazole-4-carboxylic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C22H18N4O3S MolecularWeight: 418.46832

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)COC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=NC(=CS1)COC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N4O3S/c1-15(27)23-22-24-17(14-30-22)13-29-21(28)19-12-26(18-10-6-3-7-11-18)25-20(19)16-8-4-2-5-9-16/h2-12,14H,13H2,1H3,(H,23,24,27)