(2-acetamido-1,3-thiazol-4-yl)methyl 3-(5-methylfuran-2-yl)-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 3-(5-methylfuran-2-yl)-1-phenyl-pyrazole-4-carboxylate Openeye Name: (2-acetamidothiazol-4-yl)methyl 3-(5-methyl-2-furyl)-1-phenyl-pyrazole-4-carboxylate CAS Name: 3-(5-methyl-2-furanyl)-1-phenyl-4-pyrazolecarboxylic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 3-(5-methylfuran-2-yl)-1-phenylpyrazole-4-carboxylate Traditional Name: 3-(5-methyl-2-furyl)-1-phenyl-pyrazole-4-carboxylic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C21H18N4O4S MolecularWeight: 422.45702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NN(C=C2C(=O)OCC3=CSC(=N3)NC(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(O1)C2=NN(C=C2C(=O)OCC3=CSC(=N3)NC(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O4S/c1-13-8-9-18(29-13)19-17(10-25(24-19)16-6-4-3-5-7-16)20(27)28-11-15-12-30-21(23-15)22-14(2)26/h3-10,12H,11H2,1-2H3,(H,22,23,26)